UCSF

IBScreen BuildingBlocks

Binding 10μM Binding 1μM Functional 10μM ADME/T 10μM

Binding 10μM Targets with Highest Number of Available Compounds (836 in total)

Name (Code) Description Organism Class Size Browse Download (Annotations)
5HT1B-1-E Serotonin 1b (5-HT1b) receptor (cluster #1 of 2) Eukaryotes 19 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT2A-1-E Serotonin 2a (5-HT2a) receptor (cluster #1 of 3) Eukaryotes 18 Annotations Catalogs SMILES SDF Mol2 Flexibase
KCNH2-1-E HERG (cluster #1 of 5) Eukaryotes 18 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH1-4-E Carbonic anhydrase I (cluster #4 of 12) Eukaryotes 16 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z104304-1-O Adrenergic receptor alpha-1 (cluster #1 of 3) Other 16 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT1A-1-E Serotonin 1a (5-HT1a) receptor (cluster #1 of 4) Eukaryotes 15 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT2C-1-E Serotonin 2c (5-HT2c) receptor (cluster #1 of 3) Eukaryotes 15 Annotations Catalogs SMILES SDF Mol2 Flexibase
HRH1-2-E Histamine H1 receptor (cluster #2 of 2) Eukaryotes 15 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT1D-1-E Serotonin 1d (5-HT1d) receptor (cluster #1 of 2) Eukaryotes 13 Annotations Catalogs SMILES SDF Mol2 Flexibase
A3EZI9-1-V Hepatitis C virus NS3 protease/helicase (cluster #1 of 3) Viruses 13 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH14-4-E Carbonic anhydrase XIV (cluster #4 of 8) Eukaryotes 13 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH2-13-E Carbonic anhydrase II (cluster #13 of 15) Eukaryotes 13 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH9-3-E Carbonic anhydrase IX (cluster #3 of 11) Eukaryotes 13 Annotations Catalogs SMILES SDF Mol2 Flexibase
DRD3-1-E Dopamine D3 receptor (cluster #1 of 2) Eukaryotes 13 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT2B-1-E Serotonin 2b (5-HT2b) receptor (cluster #1 of 4) Eukaryotes 12 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH12-2-E Carbonic anhydrase XII (cluster #2 of 9) Eukaryotes 12 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH13-1-E Carbonic anhydrase XIII (cluster #1 of 7) Eukaryotes 12 Annotations Catalogs SMILES SDF Mol2 Flexibase
DRD1-1-E Dopamine D1 receptor (cluster #1 of 4) Eukaryotes 12 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT6R-1-E Serotonin 6 (5-HT6) receptor (cluster #1 of 2) Eukaryotes 11 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH5A-6-E Carbonic anhydrase VA (cluster #6 of 10) Eukaryotes 11 Annotations Catalogs SMILES SDF Mol2 Flexibase
SCN1A-1-E Sodium channel protein type I alpha subunit (cluster #1 of 2) Eukaryotes 11 Annotations Catalogs SMILES SDF Mol2 Flexibase
SCN3A-1-E Sodium channel protein type III alpha subunit (cluster #1 of 2) Eukaryotes 11 Annotations Catalogs SMILES SDF Mol2 Flexibase
SCN8A-1-E Sodium channel protein type VIII alpha subunit (cluster #1 of 2) Eukaryotes 11 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT1F-1-E Serotonin 1f (5-HT1f) receptor (cluster #1 of 2) Eukaryotes 10 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT4R-1-E Serotonin 4 (5-HT4) receptor (cluster #1 of 1) Eukaryotes 10 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADA1B-1-E Alpha-1b adrenergic receptor (cluster #1 of 4) Eukaryotes 10 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADA2A-3-E Alpha-2a adrenergic receptor (cluster #3 of 4) Eukaryotes 10 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADA2C-1-E Alpha-2c adrenergic receptor (cluster #1 of 4) Eukaryotes 10 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH12-1-E Carbonic anhydrase XII (cluster #1 of 9) Eukaryotes 10 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH2-6-E Carbonic anhydrase II (cluster #6 of 15) Eukaryotes 10 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH7-2-E Carbonic anhydrase VII (cluster #2 of 8) Eukaryotes 10 Annotations Catalogs SMILES SDF Mol2 Flexibase
KCNH2-5-E HERG (cluster #5 of 5) Eukaryotes 10 Annotations Catalogs SMILES SDF Mol2 Flexibase
PRGR-1-E Progesterone receptor (cluster #1 of 3) Eukaryotes 10 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADA2A-1-E Alpha-2a adrenergic receptor (cluster #1 of 4) Eukaryotes 9 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADA2B-1-E Alpha-2b adrenergic receptor (cluster #1 of 4) Eukaryotes 9 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADA2C-3-E Alpha-2c adrenergic receptor (cluster #3 of 4) Eukaryotes 9 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADRB1-2-E Beta-1 adrenergic receptor (cluster #2 of 2) Eukaryotes 9 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADRB2-1-E Beta-2 adrenergic receptor (cluster #1 of 2) Eukaryotes 9 Annotations Catalogs SMILES SDF Mol2 Flexibase
ANDR-2-E Androgen Receptor (cluster #2 of 4) Eukaryotes 9 Annotations Catalogs SMILES SDF Mol2 Flexibase
AOFB-2-E Monoamine oxidase B (cluster #2 of 8) Eukaryotes 9 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH4-1-E Carbonic anhydrase IV (cluster #1 of 16) Eukaryotes 9 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH9-1-E Carbonic anhydrase IX (cluster #1 of 11) Eukaryotes 9 Annotations Catalogs SMILES SDF Mol2 Flexibase
PGH1-2-E Cyclooxygenase-1 (cluster #2 of 6) Eukaryotes 9 Annotations Catalogs SMILES SDF Mol2 Flexibase
SGMR1-1-E Sigma opioid receptor (cluster #1 of 6) Eukaryotes 9 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT5A-1-E Serotonin 5a (5-HT5a) receptor (cluster #1 of 1) Eukaryotes 8 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACE-1-E Angiotensin-converting enzyme (cluster #1 of 1) Eukaryotes 8 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH2-5-E Carbonic anhydrase II (cluster #5 of 15) Eukaryotes 8 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH3-1-E Carbonic anhydrase III (cluster #1 of 6) Eukaryotes 8 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH5A-1-E Carbonic anhydrase VA (cluster #1 of 10) Eukaryotes 8 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH5B-1-E Carbonic anhydrase VB (cluster #1 of 9) Eukaryotes 8 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH5B-4-E Carbonic anhydrase VB (cluster #4 of 9) Eukaryotes 8 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH6-7-E Carbonic anhydrase VI (cluster #7 of 8) Eukaryotes 8 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH6-8-E Carbonic anhydrase VI (cluster #8 of 8) Eukaryotes 8 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH7-1-E Carbonic anhydrase VII (cluster #1 of 8) Eukaryotes 8 Annotations Catalogs SMILES SDF Mol2 Flexibase
HCAR2-2-E HM74 nicotinic acid GPCR (cluster #2 of 4) Eukaryotes 8 Annotations Catalogs SMILES SDF Mol2 Flexibase
OPRM-1-E Mu-type opioid receptor (cluster #1 of 4) Eukaryotes 8 Annotations Catalogs SMILES SDF Mol2 Flexibase
PGH2-1-E Cyclooxygenase-2 (cluster #1 of 8) Eukaryotes 8 Annotations Catalogs SMILES SDF Mol2 Flexibase
SCN2A-1-E Sodium channel protein type II alpha subunit (cluster #1 of 2) Eukaryotes 8 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT1A-3-E Serotonin 1a (5-HT1a) receptor (cluster #3 of 4) Eukaryotes 7 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT7R-1-E Serotonin 7 (5-HT7) receptor (cluster #1 of 3) Eukaryotes 7 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADA1D-1-E Alpha-1d adrenergic receptor (cluster #1 of 3) Eukaryotes 7 Annotations Catalogs SMILES SDF Mol2 Flexibase
ALDR-1-E Aldose reductase (cluster #1 of 5) Eukaryotes 7 Annotations Catalogs SMILES SDF Mol2 Flexibase
AOFA-4-E Monoamine oxidase A (cluster #4 of 8) Eukaryotes 7 Annotations Catalogs SMILES SDF Mol2 Flexibase
B5SU02-2-E Alpha carbonic anhydrase (cluster #2 of 6) Eukaryotes 7 Annotations Catalogs SMILES SDF Mol2 Flexibase
C0IX24-1-E Carbonic anhydrase (cluster #1 of 5) Eukaryotes 7 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH14-1-E Carbonic anhydrase XIV (cluster #1 of 8) Eukaryotes 7 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH4-3-E Carbonic anhydrase IV (cluster #3 of 16) Eukaryotes 7 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH6-2-E Carbonic anhydrase VI (cluster #2 of 8) Eukaryotes 7 Annotations Catalogs SMILES SDF Mol2 Flexibase
CYNT-1-B Carbonic anhydrase (cluster #1 of 3) Bacteria 7 Annotations Catalogs SMILES SDF Mol2 Flexibase
DRD5-1-E Dopamine D5 receptor (cluster #1 of 1) Eukaryotes 7 Annotations Catalogs SMILES SDF Mol2 Flexibase
GCR-2-E Glucocorticoid receptor (cluster #2 of 2) Eukaryotes 7 Annotations Catalogs SMILES SDF Mol2 Flexibase
MGLL-2-E Monoglyceride lipase (cluster #2 of 7) Eukaryotes 7 Annotations Catalogs SMILES SDF Mol2 Flexibase
Q5AJ71-1-F Carbonic anhydrase (cluster #1 of 4) Fungi 7 Annotations Catalogs SMILES SDF Mol2 Flexibase
SC6A4-1-E Serotonin transporter (cluster #1 of 4) Eukaryotes 7 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT3B-1-E Serotonin 3b (5-HT3b) receptor (cluster #1 of 4) Eukaryotes 6 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT3B-2-E Serotonin 3b (5-HT3b) receptor (cluster #2 of 4) Eukaryotes 6 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT3C-2-E Serotonin 3c (5-HT3c) receptor (cluster #2 of 2) Eukaryotes 6 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT3D-2-E Serotonin 3d (5-HT3d) receptor (cluster #2 of 2) Eukaryotes 6 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT3E-2-E Serotonin 3e (5-HT3e) receptor (cluster #2 of 2) Eukaryotes 6 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADA1A-3-E Alpha-1a adrenergic receptor (cluster #3 of 3) Eukaryotes 6 Annotations Catalogs SMILES SDF Mol2 Flexibase
AOFB-4-E Monoamine oxidase B (cluster #4 of 8) Eukaryotes 6 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAC1C-1-E Voltage-gated L-type calcium channel alpha-1C subunit (cluster #1 of 1) Eukaryotes 6 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH-1-A Carbonic anhydrase (cluster #1 of 2) Archaea 6 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH1-5-E Carbonic anhydrase I (cluster #5 of 12) Eukaryotes 6 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH12-9-E Carbonic anhydrase XII (cluster #9 of 9) Eukaryotes 6 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH15-2-E Carbonic anhydrase 15 (cluster #2 of 6) Eukaryotes 6 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH3-2-E Carbonic anhydrase III (cluster #2 of 6) Eukaryotes 6 Annotations Catalogs SMILES SDF Mol2 Flexibase
CDK1-1-E Cyclin-dependent kinase 1 (cluster #1 of 4) Eukaryotes 6 Annotations Catalogs SMILES SDF Mol2 Flexibase
CP19A-2-E Cytochrome P450 19A1 (cluster #2 of 3) Eukaryotes 6 Annotations Catalogs SMILES SDF Mol2 Flexibase
DRD2-2-E Dopamine D2 receptor (cluster #2 of 24) Eukaryotes 6 Annotations Catalogs SMILES SDF Mol2 Flexibase
GBRA1-1-E GABA receptor alpha-1 subunit (cluster #1 of 8) Eukaryotes 6 Annotations Catalogs SMILES SDF Mol2 Flexibase
GBRA2-1-E GABA receptor alpha-2 subunit (cluster #1 of 8) Eukaryotes 6 Annotations Catalogs SMILES SDF Mol2 Flexibase
GBRA3-1-E GABA receptor alpha-3 subunit (cluster #1 of 8) Eukaryotes 6 Annotations Catalogs SMILES SDF Mol2 Flexibase
GSK3B-7-E Glycogen synthase kinase-3 beta (cluster #7 of 7) Eukaryotes 6 Annotations Catalogs SMILES SDF Mol2 Flexibase
HRH1-1-E Histamine H1 receptor (cluster #1 of 2) Eukaryotes 6 Annotations Catalogs SMILES SDF Mol2 Flexibase
Q2PCB5-2-E Carbonic anhydrase (cluster #2 of 2) Eukaryotes 6 Annotations Catalogs SMILES SDF Mol2 Flexibase
Q72547-1-V Human immunodeficiency virus type 1 reverse transcriptase (cluster #1 of 6) Viruses 6 Annotations Catalogs SMILES SDF Mol2 Flexibase
Q965D7-2-E Fatty acid synthase (cluster #2 of 2) Eukaryotes 6 Annotations Catalogs SMILES SDF Mol2 Flexibase
SGMR1-4-E Sigma opioid receptor (cluster #4 of 6) Eukaryotes 6 Annotations Catalogs SMILES SDF Mol2 Flexibase
XDH-2-E Xanthine dehydrogenase (cluster #2 of 2) Eukaryotes 6 Annotations Catalogs SMILES SDF Mol2 Flexibase
Y1284-1-B Uncharacterized protein Rv1284/MT1322 (cluster #1 of 2) Bacteria 6 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT1A-4-E Serotonin 1a (5-HT1a) receptor (cluster #4 of 4) Eukaryotes 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT2A-2-E Serotonin 2a (5-HT2a) receptor (cluster #2 of 3) Eukaryotes 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT3A-1-E Serotonin 3a (5-HT3a) receptor (cluster #1 of 5) Eukaryotes 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT3A-2-E Serotonin 3a (5-HT3a) receptor (cluster #2 of 5) Eukaryotes 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
AA1R-2-E Adenosine A1 receptor (cluster #2 of 4) Eukaryotes 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
ABCG2-1-E ATP-binding cassette sub-family G member 2 (cluster #1 of 2) Eukaryotes 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACHA4-1-E Neuronal acetylcholine receptor protein alpha-4 subunit (cluster #1 of 5) Eukaryotes 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACHA7-1-E Neuronal acetylcholine receptor protein alpha-7 subunit (cluster #1 of 6) Eukaryotes 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADA1A-1-E Alpha-1a adrenergic receptor (cluster #1 of 3) Eukaryotes 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADA2B-4-E Alpha-2b adrenergic receptor (cluster #4 of 4) Eukaryotes 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAC1D-1-E Voltage-gated L-type calcium channel alpha-1D subunit (cluster #1 of 2) Eukaryotes 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH1-12-E Carbonic anhydrase I (cluster #12 of 12) Eukaryotes 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH15-1-E Carbonic anhydrase 15 (cluster #1 of 6) Eukaryotes 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH2-1-E Carbonic anhydrase II (cluster #1 of 15) Eukaryotes 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH4-14-E Carbonic anhydrase IV (cluster #14 of 16) Eukaryotes 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH7-8-E Carbonic anhydrase VII (cluster #8 of 8) Eukaryotes 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH9-11-E Carbonic anhydrase IX (cluster #11 of 11) Eukaryotes 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
CP1B1-1-E Cytochrome P450 1B1 (cluster #1 of 1) Eukaryotes 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
DHB3-2-E Estradiol 17-beta-dehydrogenase 3 (cluster #2 of 4) Eukaryotes 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
EST1-1-E Carboxylesterase (cluster #1 of 7) Eukaryotes 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
GBRA4-1-E GABA receptor alpha-4 subunit (cluster #1 of 7) Eukaryotes 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
MCR-1-E Mineralocorticoid receptor (cluster #1 of 2) Eukaryotes 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
NISCH-2-E Nischarin (cluster #2 of 4) Eukaryotes 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
OPRD-1-E Delta opioid receptor (cluster #1 of 3) Eukaryotes 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
P96878-1-B PROBABLE TRANSMEMBRANE CARBONIC ANHYDRASE (CARBONATE DEHYDRATASE) (CARBONIC DEHYDRATASE) (cluster #1 of 2) Bacteria 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
PPARG-1-E Peroxisome proliferator-activated receptor gamma (cluster #1 of 2) Eukaryotes 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
Q7ZJM1-1-V Human immunodeficiency virus type 1 integrase (cluster #1 of 6) Viruses 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
Q965D6-1-E 3-oxoacyl-acyl-carrier protein reductase (cluster #1 of 2) Eukaryotes 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
SC6A3-1-E Dopamine transporter (cluster #1 of 3) Eukaryotes 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z104301-1-O GABA-A receptor; anion channel (cluster #1 of 8) Other 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50597-1-O Rattus norvegicus (cluster #1 of 5) Other 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT5B-1-E Serotonin 5b (5-HT5b) receptor (cluster #1 of 1) Eukaryotes 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
AA2AR-1-E Adenosine A2a receptor (cluster #1 of 4) Eukaryotes 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
AA3R-1-E Adenosine receptor A3 (cluster #1 of 6) Eukaryotes 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
AA3R-3-E Adenosine receptor A3 (cluster #3 of 6) Eukaryotes 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACHB2-4-E Neuronal acetylcholine receptor protein beta-2 subunit (cluster #4 of 7) Eukaryotes 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADA2B-3-E Alpha-2b adrenergic receptor (cluster #3 of 4) Eukaryotes 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADCY2-2-E Adenylate cyclase type II (cluster #2 of 2) Eukaryotes 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADCY8-1-E Adenylate cyclase type VIII (cluster #1 of 2) Eukaryotes 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADRB1-1-E Beta-1 adrenergic receptor (cluster #1 of 2) Eukaryotes 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADRB3-1-E Beta-3 adrenergic receptor (cluster #1 of 2) Eukaryotes 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
AOFA-1-E Monoamine oxidase A (cluster #1 of 8) Eukaryotes 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
ATP4A-1-E Potassium-transporting ATPase alpha chain 1 (cluster #1 of 1) Eukaryotes 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
ATP4B-1-E Potassium-transporting ATPase beta chain (cluster #1 of 1) Eukaryotes 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH15-4-E Carbonic anhydrase 15 (cluster #4 of 6) Eukaryotes 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH2-15-E Carbonic anhydrase II (cluster #15 of 15) Eukaryotes 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAN-1-F Carbonic anhydrase (cluster #1 of 3) Fungi 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
CCNB1-1-E G2/mitotic-specific cyclin B1 (cluster #1 of 2) Eukaryotes 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
CCNB2-1-E G2/mitotic-specific cyclin B2 (cluster #1 of 2) Eukaryotes 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
CCNB3-1-E G2/mitotic-specific cyclin B3 (cluster #1 of 2) Eukaryotes 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
CP19A-1-E Cytochrome P450 19A1 (cluster #1 of 3) Eukaryotes 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
ESR1-1-E Estrogen receptor alpha (cluster #1 of 5) Eukaryotes 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
ESR1-2-E Estrogen receptor alpha (cluster #2 of 5) Eukaryotes 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
ESR2-2-E Estrogen receptor beta (cluster #2 of 4) Eukaryotes 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
GSK3A-1-E Glycogen synthase kinase-3 alpha (cluster #1 of 3) Eukaryotes 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
GYRA-1-B DNA gyrase subunit A (cluster #1 of 1) Bacteria 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
GYRB-1-B DNA gyrase subunit B (cluster #1 of 1) Bacteria 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
I23O1-1-E Indoleamine 2,3-dioxygenase 1 (cluster #1 of 5) Eukaryotes 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
NOS2-8-E Nitric oxide synthase, inducible (cluster #8 of 9) Eukaryotes 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
NOS3-6-E Nitric oxide synthase, endothelial (cluster #6 of 7) Eukaryotes 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
OPRK-1-E Kappa opioid receptor (cluster #1 of 6) Eukaryotes 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
PARC-1-B Topoisomerase IV subunit A (cluster #1 of 1) Bacteria 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
PGH2-4-E Cyclooxygenase-2 (cluster #4 of 8) Eukaryotes 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
PPARA-1-E Peroxisome proliferator-activated receptor alpha (cluster #1 of 3) Eukaryotes 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
Q965D5-1-E Enoyl-acyl-carrier protein reductase (cluster #1 of 1) Eukaryotes 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
S22A6-1-E Solute carrier family 22 member 6 (cluster #1 of 3) Eukaryotes 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
SC6A2-1-E Norepinephrine transporter (cluster #1 of 2) Eukaryotes 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z104283-1-O Neuronal acetylcholine receptor; alpha4/beta2 (cluster #1 of 4) Other 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z104288-1-O Neuronal acetylcholine receptor; alpha3/beta4 (cluster #1 of 2) Other 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z104294-2-O Cyclin-dependent kinase 5/CDK5 activator 1 (cluster #2 of 2) Other 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z104302-3-O Glutamate NMDA receptor (cluster #3 of 7) Other 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z104304-2-O Adrenergic receptor alpha-1 (cluster #2 of 3) Other 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT1D-2-E Serotonin 1d (5-HT1d) receptor (cluster #2 of 2) Eukaryotes 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT1E-2-E Serotonin 1e (5-HT1e) receptor (cluster #2 of 2) Eukaryotes 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT1F-2-E Serotonin 1f (5-HT1f) receptor (cluster #2 of 2) Eukaryotes 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT2B-2-E Serotonin 2b (5-HT2b) receptor (cluster #2 of 4) Eukaryotes 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT2C-2-E Serotonin 2c (5-HT2c) receptor (cluster #2 of 3) Eukaryotes 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT3A-5-E Serotonin 3a (5-HT3a) receptor (cluster #5 of 5) Eukaryotes 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT3C-1-E Serotonin 3c (5-HT3c) receptor (cluster #1 of 2) Eukaryotes 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT3D-1-E Serotonin 3d (5-HT3d) receptor (cluster #1 of 2) Eukaryotes 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT3E-1-E Serotonin 3e (5-HT3e) receptor (cluster #1 of 2) Eukaryotes 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT7R-2-E Serotonin 7 (5-HT7) receptor (cluster #2 of 3) Eukaryotes 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
A4-2-E Beta amyloid A4 protein (cluster #2 of 5) Eukaryotes 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACES-1-E Acetylcholinesterase (cluster #1 of 12) Eukaryotes 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACH10-2-E Neuronal acetylcholine receptor protein alpha-10 subunit (cluster #2 of 4) Eukaryotes 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACHA3-3-E Neuronal acetylcholine receptor protein alpha-3 subunit (cluster #3 of 5) Eukaryotes 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACHA3-4-E Neuronal acetylcholine receptor protein alpha-3 subunit (cluster #4 of 5) Eukaryotes 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACHB-1-E Acetylcholine receptor protein beta chain (cluster #1 of 4) Eukaryotes 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACHB4-6-E Neuronal acetylcholine receptor subunit beta-4 (cluster #6 of 7) Eukaryotes 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACHD-1-E Acetylcholine receptor protein delta chain (cluster #1 of 3) Eukaryotes 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
AGTR1-1-E Type-1 angiotensin II receptor (cluster #1 of 2) Eukaryotes 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
AGTRA-1-E Angiotensin II type 1a (AT-1a) receptor (cluster #1 of 1) Eukaryotes 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
AGTRB-1-E Angiotensin II type 1b (AT-1b) receptor (cluster #1 of 1) Eukaryotes 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
AMPM-3-B Methionine aminopeptidase (cluster #3 of 3) Bacteria 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
AOFA-2-E Monoamine oxidase A (cluster #2 of 8) Eukaryotes 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
AOFB-6-E Monoamine oxidase B (cluster #6 of 8) Eukaryotes 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAC1F-1-E Voltage-gated L-type calcium channel alpha-1F subunit (cluster #1 of 1) Eukaryotes 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAC1S-1-E Voltage-gated L-type calcium channel alpha-1S subunit (cluster #1 of 1) Eukaryotes 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH1-1-E Carbonic anhydrase I (cluster #1 of 12) Eukaryotes 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH12-4-E Carbonic anhydrase XII (cluster #4 of 9) Eukaryotes 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH13-6-E Carbonic anhydrase XIII (cluster #6 of 7) Eukaryotes 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH3-6-E Carbonic anhydrase III (cluster #6 of 6) Eukaryotes 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH9-9-E Carbonic anhydrase IX (cluster #9 of 11) Eukaryotes 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
CDK6-1-E Cyclin-dependent kinase 6 (cluster #1 of 1) Eukaryotes 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
CHLE-2-E Butyrylcholinesterase (cluster #2 of 7) Eukaryotes 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
CP51-1-B Sterol 14-alpha demethylase (cluster #1 of 2) Bacteria 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
CSK21-2-E Casein kinase II alpha (cluster #2 of 3) Eukaryotes 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
CSK2B-3-E Casein kinase II beta (cluster #3 of 3) Eukaryotes 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
DHB1-1-E Estradiol 17-beta-dehydrogenase 1 (cluster #1 of 1) Eukaryotes 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
DRD2-14-E Dopamine D2 receptor (cluster #14 of 24) Eukaryotes 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
DRD2-15-E Dopamine D2 receptor (cluster #15 of 24) Eukaryotes 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
DRD2-4-E Dopamine D2 receptor (cluster #4 of 24) Eukaryotes 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
DRD4-2-E Dopamine D4 receptor (cluster #2 of 4) Eukaryotes 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
DRD4-3-E Dopamine D4 receptor (cluster #3 of 4) Eukaryotes 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
EGFR-2-E Epidermal growth factor receptor erbB1 (cluster #2 of 4) Eukaryotes 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
ESR2-4-E Estrogen receptor beta (cluster #4 of 4) Eukaryotes 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
EST1-6-E Carboxylesterase (cluster #6 of 7) Eukaryotes 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
FABPL-3-E Fatty acid-binding protein, liver (cluster #3 of 4) Eukaryotes 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
GBRA5-6-E GABA receptor alpha-5 subunit (cluster #6 of 8) Eukaryotes 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
GBRA6-6-E GABA receptor alpha-6 subunit (cluster #6 of 8) Eukaryotes 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
GSK3A-2-E Glycogen synthase kinase-3 alpha (cluster #2 of 3) Eukaryotes 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
LGUL-2-E Glyoxalase I (cluster #2 of 2) Eukaryotes 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
LOX12-2-E Arachidonate 12-lipoxygenase (cluster #2 of 4) Eukaryotes 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
LOX15-1-E Arachidonate 15-lipoxygenase (cluster #1 of 5) Eukaryotes 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
LOX5-1-E Arachidonate 5-lipoxygenase (cluster #1 of 6) Eukaryotes 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
LOX5-6-E Arachidonate 5-lipoxygenase (cluster #6 of 6) Eukaryotes 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
MDR1-2-E P-glycoprotein 1 (cluster #2 of 3) Eukaryotes 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
MRP1-1-E Multidrug resistance-associated protein 1 (cluster #1 of 1) Eukaryotes 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
NMDZ1-4-E Glutamate (NMDA) receptor subunit zeta 1 (cluster #4 of 6) Eukaryotes 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
NOX4-1-E NADPH oxidase 4 (cluster #1 of 1) Eukaryotes 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
OXDA-2-E D-amino-acid oxidase (cluster #2 of 2) Eukaryotes 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
PARP1-2-E Poly [ADP-ribose] polymerase 1 (cluster #2 of 3) Eukaryotes 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
PARP1-3-E Poly [ADP-ribose] polymerase 1 (cluster #3 of 3) Eukaryotes 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
PGH1-1-E Cyclooxygenase-1 (cluster #1 of 6) Eukaryotes 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
PRIO-1-E Prion protein (cluster #1 of 1) Eukaryotes 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
Q63380-1-E Transporter (cluster #1 of 1) Eukaryotes 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
Q72874-1-V Human immunodeficiency virus type 1 protease (cluster #1 of 3) Viruses 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
Q9WTR4-1-E Norepinephrine transporter (cluster #1 of 2) Eukaryotes 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
S5A1-1-E Steroid 5-alpha-reductase 1 (cluster #1 of 2) Eukaryotes 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
S5A2-1-E Steroid 5-alpha-reductase 2 (cluster #1 of 2) Eukaryotes 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
SC6A1-2-E GABA transporter 1 (cluster #2 of 2) Eukaryotes 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
SC6A2-2-E Norepinephrine transporter (cluster #2 of 2) Eukaryotes 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
SC6A4-3-E Serotonin transporter (cluster #3 of 4) Eukaryotes 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
SCN2A-2-E Sodium channel protein type II alpha subunit (cluster #2 of 2) Eukaryotes 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
SRC-1-E Tyrosine-protein kinase SRC (cluster #1 of 3) Eukaryotes 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
TBB1-1-E Tubulin beta-1 chain (cluster #1 of 2) Eukaryotes 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z104290-1-O Neuronal acetylcholine receptor; alpha4/beta2 (cluster #1 of 4) Other 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z104303-1-O Muscarinic acetylcholine receptor (cluster #1 of 7) Other 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT1E-1-E Serotonin 1e (5-HT1e) receptor (cluster #1 of 2) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT2B-3-E Serotonin 2b (5-HT2b) receptor (cluster #3 of 4) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT2C-3-E Serotonin 2c (5-HT2c) receptor (cluster #3 of 3) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT6R-2-E Serotonin 6 (5-HT6) receptor (cluster #2 of 2) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
A1E3K9-1-B Beta-lactamase SCO-1 (cluster #1 of 1) Bacteria 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
A8RR46-1-B Beta-lactamase (cluster #1 of 1) Bacteria 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
AA2AR-3-E Adenosine A2a receptor (cluster #3 of 4) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
AA2BR-1-E Adenosine A2b receptor (cluster #1 of 1) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
AA3R-6-E Adenosine receptor A3 (cluster #6 of 6) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACE2-1-E Angiotensin-converting enzyme 2 (cluster #1 of 1) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACHA7-5-E Neuronal acetylcholine receptor protein alpha-7 subunit (cluster #5 of 6) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACHA9-4-E Neuronal acetylcholine receptor protein alpha-9 subunit (cluster #4 of 4) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACHB3-4-E Neuronal acetylcholine receptor subunit beta-3 (cluster #4 of 4) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACHB4-5-E Neuronal acetylcholine receptor subunit beta-4 (cluster #5 of 7) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACHG-1-E Acetylcholine receptor protein gamma chain (cluster #1 of 3) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACM1-1-E Muscarinic acetylcholine receptor M1 (cluster #1 of 5) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACM1-3-E Muscarinic acetylcholine receptor M1 (cluster #3 of 5) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADA1A-2-E Alpha-1a adrenergic receptor (cluster #2 of 3) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADA2A-2-E Alpha-2a adrenergic receptor (cluster #2 of 4) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADCY1-1-E Brain adenylate cyclase 1 (cluster #1 of 1) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADCY3-2-E Adenylate cyclase type III (cluster #2 of 2) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADCY4-2-E Adenylate cyclase type IV (cluster #2 of 2) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADCY5-2-E Adenylate cyclase type V (cluster #2 of 2) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADCY6-2-E Adenylate cyclase type VI (cluster #2 of 2) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
AK1A1-1-E Aldehyde reductase (cluster #1 of 1) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ALBU-1-E Serum albumin (cluster #1 of 1) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
AMPC-5-B Beta-lactamase (cluster #5 of 6) Bacteria 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
AOFB-1-E Monoamine oxidase B (cluster #1 of 8) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
BLAC-1-B Beta-lactamase (cluster #1 of 1) Bacteria 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
BLAT-3-B Beta-lactamase TEM (cluster #3 of 4) Bacteria 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
C3SLN2-1-B DNA gyrase subunit B (cluster #1 of 1) Bacteria 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH12-3-E Carbonic anhydrase XII (cluster #3 of 9) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH13-5-E Carbonic anhydrase XIII (cluster #5 of 7) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH14-2-E Carbonic anhydrase XIV (cluster #2 of 8) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH15-3-E Carbonic anhydrase 15 (cluster #3 of 6) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH3-3-E Carbonic anhydrase III (cluster #3 of 6) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH4-2-E Carbonic anhydrase IV (cluster #2 of 16) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH4-4-E Carbonic anhydrase IV (cluster #4 of 16) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH5A-4-E Carbonic anhydrase VA (cluster #4 of 10) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH5A-8-E Carbonic anhydrase VA (cluster #8 of 10) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH5B-5-E Carbonic anhydrase VB (cluster #5 of 9) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH5B-6-E Carbonic anhydrase VB (cluster #6 of 9) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH6-3-E Carbonic anhydrase VI (cluster #3 of 8) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH6-4-E Carbonic anhydrase VI (cluster #4 of 8) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH7-3-E Carbonic anhydrase VII (cluster #3 of 8) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH7-4-E Carbonic anhydrase VII (cluster #4 of 8) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH9-4-E Carbonic anhydrase IX (cluster #4 of 11) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
CALM-2-E Calmodulin (cluster #2 of 2) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
CBPA1-1-E Carboxypeptidase A1 (cluster #1 of 1) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
CBPA3-1-E Mast cell carboxypeptidase A (cluster #1 of 1) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
CBPB1-2-E Carboxypeptidase B (cluster #2 of 3) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
CBPB2-1-E Carboxypeptidase B2 isoform A (cluster #1 of 2) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
CBR1-1-E Carbonyl reductase [NADPH] 1 (cluster #1 of 2) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
CDK2-1-E Cyclin-dependent kinase 2 (cluster #1 of 5) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
CHLE-1-E Butyrylcholinesterase (cluster #1 of 7) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
CLTR2-1-E Cysteinyl leukotriene receptor 2 (cluster #1 of 1) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
CP19A-3-E Cytochrome P450 19A1 (cluster #3 of 3) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
D1MIX9-1-B Beta-lactamase GES-13 (cluster #1 of 1) Bacteria 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
D4A3N4-1-E Brain adenylate cyclase 1 (cluster #1 of 1) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
DHB2-1-E Estradiol 17-beta-dehydrogenase 2 (cluster #1 of 2) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
DHI1-1-E 11-beta-hydroxysteroid dehydrogenase 1 (cluster #1 of 3) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
DRD1-2-E Dopamine D1 receptor (cluster #2 of 4) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
DRD2-11-E Dopamine D2 receptor (cluster #11 of 24) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
DRD2-23-E Dopamine D2 receptor (cluster #23 of 24) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
DRD2-3-E Dopamine D2 receptor (cluster #3 of 24) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
DRD4-1-E Dopamine D4 receptor (cluster #1 of 4) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
DRTS-1-E Bifunctional dihydrofolate reductase-thymidylate synthase (cluster #1 of 3) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
DYR-1-E Dihydrofolate reductase (cluster #1 of 3) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ERG1-3-E Squalene monooxygenase (cluster #3 of 3) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ERG2-1-F C-8 sterol isomerase (cluster #1 of 2) Fungi 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
EST2-3-E Carboxylesterase 2 (cluster #3 of 5) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
FABPL-1-E Fatty acid-binding protein, liver (cluster #1 of 4) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
FPPS-1-E Farnesyl diphosphate synthase (cluster #1 of 1) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
GABR1-1-E GABA-B receptor 1 (cluster #1 of 3) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
GABR2-1-E GABA-B receptor 2 (cluster #1 of 3) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
GASR-1-E Cholecystokinin B receptor (cluster #1 of 1) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
GBRA5-1-E GABA receptor alpha-5 subunit (cluster #1 of 8) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
GBRB3-4-E GABA receptor beta-3 subunit (cluster #4 of 6) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
GSK3B-3-E Glycogen synthase kinase-3 beta (cluster #3 of 7) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
HRH3-1-E Histamine H3 receptor (cluster #1 of 3) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
KCNH2-2-E HERG (cluster #2 of 5) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
KCNH2-3-E HERG (cluster #3 of 5) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
KCNH2-4-E HERG (cluster #4 of 5) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
LOX1-1-E Seed lipoxygenase-1 (cluster #1 of 3) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
LOX5-4-E Arachidonate 5-lipoxygenase (cluster #4 of 6) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
LT4R1-1-E Leukotriene B4 receptor 1 (cluster #1 of 2) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
MET-1-E Hepatocyte growth factor receptor (cluster #1 of 1) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
MIF-1-E Macrophage migration inhibitory factor (cluster #1 of 3) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
MPIP2-1-E Dual specificity phosphatase Cdc25B (cluster #1 of 2) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
MTR1B-2-E Melatonin receptor 1B (cluster #2 of 2) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
NANH-1-B Sialidase (cluster #1 of 1) Bacteria 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
NMD3A-5-E Glutamate [NMDA] receptor subunit 3A (cluster #5 of 6) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
NMD3B-5-E Glutamate [NMDA] receptor subunit 3B (cluster #5 of 6) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
NMDE1-5-E Glutamate [NMDA] receptor subunit epsilon 1 (cluster #5 of 5) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
NMDE3-1-E Glutamate [NMDA] receptor subunit epsilon 3 (cluster #1 of 4) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
NMDE4-5-E Glutamate [NMDA] receptor subunit epsilon 4 (cluster #5 of 6) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
NMDZ1-6-E Glutamate (NMDA) receptor subunit zeta 1 (cluster #6 of 6) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
NOS1-3-E Nitric-oxide synthase, brain (cluster #3 of 7) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
NOS1-4-E Nitric-oxide synthase, brain (cluster #4 of 7) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
NOS1-5-E Nitric-oxide synthase, brain (cluster #5 of 7) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
NOS3-5-E Nitric oxide synthase, endothelial (cluster #5 of 7) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
NQO2-1-E Quinone reductase 2 (cluster #1 of 4) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
O77823-1-E Phosphodiesterase 4A (cluster #1 of 1) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
P97706-1-E Sodium channel protein type VI alpha subunit (cluster #1 of 1) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
PDE10-1-E Phosphodiesterase 10A (cluster #1 of 1) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
PDE2A-1-E Phosphodiesterase 2A (cluster #1 of 1) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
PDE4A-1-E Phosphodiesterase 4A (cluster #1 of 3) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
PDE4B-1-E Phosphodiesterase 4B (cluster #1 of 2) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
PDE4C-1-E Phosphodiesterase 4C (cluster #1 of 2) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
PDE4D-1-E Phosphodiesterase 4D (cluster #1 of 2) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
PDR5-1-F Pleiotropic ABC efflux transporter of multiple drugs (cluster #1 of 1) Fungi 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
PGH1-4-E Cyclooxygenase-1 (cluster #4 of 6) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
PGH2-3-E Cyclooxygenase-2 (cluster #3 of 8) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
PGH2-6-E Cyclooxygenase-2 (cluster #6 of 8) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
PIM1-1-E Serine/threonine-protein kinase PIM1 (cluster #1 of 1) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
PPARD-2-E Peroxisome proliferator-activated receptor delta (cluster #2 of 2) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
PPBT-1-E Alkaline phosphatase tissue-nonspecific (cluster #1 of 1) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
PTN1-1-E Protein-tyrosine phosphatase 1B (cluster #1 of 4) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Q0GKD7-1-E Farnesyl pyrophosphate synthase (cluster #1 of 1) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Q3I4V7-1-F Carbonic anhydrase 2 (cluster #1 of 4) Fungi 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Q3I4V7-3-F Carbonic anhydrase 2 (cluster #3 of 4) Fungi 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Q47245-1-B DNA gyrase subunit A (cluster #1 of 1) Bacteria 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Q4U254-1-V Human rhinovirus A protease (cluster #1 of 3) Viruses 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Q5AJ71-2-F Carbonic anhydrase (cluster #2 of 4) Fungi 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Q862F3-2-E Tubulin alpha chain (cluster #2 of 2) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Q862L2-2-E Tubulin alpha-1 chain (cluster #2 of 2) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Q864F1-1-E Phosphodiesterase 5 (cluster #1 of 1) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Q8CFM9-1-E Adenylate cyclase type VII (cluster #1 of 1) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Q9WTR4-2-E Norepinephrine transporter (cluster #2 of 2) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
RARG-1-E Retinoic acid receptor gamma (cluster #1 of 2) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
RXRA-1-E Retinoid X receptor alpha (cluster #1 of 1) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
S22AK-1-E Solute carrier family 22 member 20 (cluster #1 of 2) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
SCN5A-1-E Sodium channel protein type V alpha subunit (cluster #1 of 1) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
SGMR1-2-E Sigma opioid receptor (cluster #2 of 6) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
TBA1A-1-E Tubulin alpha-3 chain (cluster #1 of 3) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
TBA4A-1-E Tubulin alpha-1 chain (cluster #1 of 1) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
TBB-1-E Tubulin beta chain (cluster #1 of 1) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
TBB2B-1-E Tubulin beta chain (cluster #1 of 1) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
TBB3-1-E Tubulin beta-3 chain (cluster #1 of 1) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
TBB4A-1-E Tubulin beta-4 chain (cluster #1 of 1) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
TBB4B-1-E Tubulin beta-2 chain (cluster #1 of 1) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
TBB5-1-E Tubulin beta-5 chain (cluster #1 of 1) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
TBB8-1-E Tubulin beta-8 chain (cluster #1 of 1) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
TBG1-1-E Tubulin gamma-1 chain (cluster #1 of 1) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
TOP1-1-E DNA topoisomerase 1 (cluster #1 of 2) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
TRPA1-4-E Transient receptor potential cation channel subfamily A member 1 (cluster #4 of 5) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
TRY1-1-E Trypsin I (cluster #1 of 5) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
TTHY-1-E Transthyretin (cluster #1 of 3) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
TYRO-1-F Tyrosinase (cluster #1 of 8) Fungi 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
TYRO-3-F Tyrosinase (cluster #3 of 8) Fungi 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
TYRO-7-F Tyrosinase (cluster #7 of 8) Fungi 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
TYTR-1-E Trypanothione reductase (cluster #1 of 2) Eukaryotes 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z104281-2-O Neuronal acetylcholine receptor; alpha3/beta2 (cluster #2 of 2) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z104282-1-O Acetylcholine receptor; alpha1/beta1/delta/gamma (cluster #1 of 1) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z104284-1-O Neuronal acetylcholine receptor; alpha2/beta4 (cluster #1 of 1) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z104286-2-O Neuronal acetylcholine receptor; alpha2/beta2 (cluster #2 of 2) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z104287-3-O Neuronal acetylcholine receptor; alpha3/beta4 (cluster #3 of 3) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z104289-2-O Neuronal acetylcholine receptor; alpha4/beta4 (cluster #2 of 2) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z104301-4-O GABA-A receptor; anion channel (cluster #4 of 8) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z104301-5-O GABA-A receptor; anion channel (cluster #5 of 8) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z104302-4-O Glutamate NMDA receptor (cluster #4 of 7) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50597-4-O Rattus norvegicus (cluster #4 of 5) Other 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT3A-4-E Serotonin 3a (5-HT3a) receptor (cluster #4 of 5) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
5NTD-1-E 5'-nucleotidase (cluster #1 of 1) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
6PGD-1-E 6-phosphogluconate dehydrogenase (cluster #1 of 1) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
A0ZX81-1-B Beta-lactamase (cluster #1 of 1) Bacteria 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
A2RP81-1-B PER-2 beta-lactamase (cluster #1 of 1) Bacteria 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
A4-1-E Beta amyloid A4 protein (cluster #1 of 5) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
A4KCT8-1-B Gil1 (cluster #1 of 1) Bacteria 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
AA1R-1-E Adenosine A1 receptor (cluster #1 of 4) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
AA2AR-2-E Adenosine A2a receptor (cluster #2 of 4) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
AA3R-2-E Adenosine receptor A3 (cluster #2 of 6) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
AA3R-4-E Adenosine receptor A3 (cluster #4 of 6) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ABCC9-1-E Sulfonylurea receptor 2 (cluster #1 of 2) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ABL1-1-E Tyrosine-protein kinase ABL (cluster #1 of 1) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACCN3-1-E Amiloride-sensitive cation channel 3 (cluster #1 of 2) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACES-10-E Acetylcholinesterase (cluster #10 of 12) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACES-12-E Acetylcholinesterase (cluster #12 of 12) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACES-6-E Acetylcholinesterase (cluster #6 of 12) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACES-9-E Acetylcholinesterase (cluster #9 of 12) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACHA-1-E Acetylcholine receptor protein alpha chain (cluster #1 of 4) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACHA-2-E Acetylcholine receptor protein alpha chain (cluster #2 of 4) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACHA-4-E Acetylcholine receptor protein alpha chain (cluster #4 of 4) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACHA2-1-E Neuronal acetylcholine receptor protein alpha-2 subunit (cluster #1 of 6) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACHA2-4-E Neuronal acetylcholine receptor protein alpha-2 subunit (cluster #4 of 6) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACHA2-6-E Neuronal acetylcholine receptor protein alpha-2 subunit (cluster #6 of 6) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACHA3-1-E Neuronal acetylcholine receptor protein alpha-3 subunit (cluster #1 of 5) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACHA5-3-E Neuronal acetylcholine receptor protein alpha-5 subunit (cluster #3 of 4) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACHA5-4-E Neuronal acetylcholine receptor protein alpha-5 subunit (cluster #4 of 4) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACHA6-3-E Neuronal acetylcholine receptor subunit alpha-6 (cluster #3 of 4) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACHA6-4-E Neuronal acetylcholine receptor subunit alpha-6 (cluster #4 of 4) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACHA7-2-E Neuronal acetylcholine receptor protein alpha-7 subunit (cluster #2 of 6) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACHA9-3-E Neuronal acetylcholine receptor protein alpha-9 subunit (cluster #3 of 4) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACHB2-1-E Neuronal acetylcholine receptor protein beta-2 subunit (cluster #1 of 7) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACHB2-6-E Neuronal acetylcholine receptor protein beta-2 subunit (cluster #6 of 7) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACHB3-3-E Neuronal acetylcholine receptor subunit beta-3 (cluster #3 of 4) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACHB4-1-E Neuronal acetylcholine receptor subunit beta-4 (cluster #1 of 7) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACHP-2-E Acetylcholine-binding protein (cluster #2 of 3) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACM1-2-E Muscarinic acetylcholine receptor M1 (cluster #2 of 5) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACM1-4-E Muscarinic acetylcholine receptor M1 (cluster #4 of 5) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACM2-1-E Muscarinic acetylcholine receptor M2 (cluster #1 of 6) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACM2-3-E Muscarinic acetylcholine receptor M2 (cluster #3 of 6) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACM2-4-E Muscarinic acetylcholine receptor M2 (cluster #4 of 6) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACM3-1-E Muscarinic acetylcholine receptor M3 (cluster #1 of 5) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACM3-4-E Muscarinic acetylcholine receptor M3 (cluster #4 of 5) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACM4-1-E Muscarinic acetylcholine receptor M4 (cluster #1 of 6) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACM5-2-E Muscarinic acetylcholine receptor M5 (cluster #2 of 4) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACM5-3-E Muscarinic acetylcholine receptor M5 (cluster #3 of 4) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADA1D-2-E Alpha-1d adrenergic receptor (cluster #2 of 3) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADA2B-2-E Alpha-2b adrenergic receptor (cluster #2 of 4) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADA2C-2-E Alpha-2c adrenergic receptor (cluster #2 of 4) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADK-1-E Adenosine kinase (cluster #1 of 1) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
AGTR2-1-E Angiotensin II type 2 (AT-2) receptor (cluster #1 of 1) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
AHR-1-E Aryl hydrocarbon receptor (cluster #1 of 1) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
AK1BA-1-E Aldo-keto reductase family 1 member B10 (cluster #1 of 1) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
AK1C2-1-E Aldo-keto reductase family 1 member C2 (cluster #1 of 1) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
AK1C3-1-E Aldo-keto-reductase family 1 member C3 (cluster #1 of 1) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
AK1CL-1-E Aldo-keto reductase family 1 member C21 (cluster #1 of 1) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
AL1A7-1-E Aldehyde dehydrogenase, cytosolic 1 (cluster #1 of 1) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ALDH2-1-E Aldehyde dehydrogenase (cluster #1 of 2) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ALDR-2-E Aldose reductase (cluster #2 of 5) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
AMPB-1-E Aminopeptidase B (cluster #1 of 2) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
AMPC-2-B Beta-lactamase (cluster #2 of 6) Bacteria 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
AMPE-1-E Aminopeptidase A (cluster #1 of 2) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
AMPH-2-B Penicillin-binding protein ampH (cluster #2 of 2) Bacteria 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
AMPM-1-B Methionine aminopeptidase (cluster #1 of 3) Bacteria 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
AMPM2-2-E Methionine aminopeptidase 2 (cluster #2 of 2) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
AMPN-1-E Aminopeptidase N (cluster #1 of 5) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
AOC3-2-E Amine oxidase, copper containing (cluster #2 of 2) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
AOFA-6-E Monoamine oxidase A (cluster #6 of 8) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
AROQ-1-B 3-dehydroquinate dehydratase (cluster #1 of 1) Bacteria 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
B0BL08-1-B Dihydrofolate reductase (cluster #1 of 1) Bacteria 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
B2CL1-1-E Apoptosis regulator Bcl-X (cluster #1 of 2) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
B8R6A5-1-B PenB class A beta-lactamase (cluster #1 of 1) Bacteria 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
BCL2-1-E Apoptosis regulator Bcl-2 (cluster #1 of 2) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
BGLR-1-E Beta-glucuronidase (cluster #1 of 2) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
BGLR-2-E Beta-glucuronidase (cluster #2 of 2) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
BLA1-1-B Beta-lactamase L1 (cluster #1 of 3) Bacteria 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
BLA1-3-B Beta-lactamase L1 (cluster #3 of 3) Bacteria 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
BLKPC-1-B Carbepenem-hydrolyzing beta-lactamase KPC (cluster #1 of 1) Bacteria 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CA2D1-1-E Voltage-gated calcium channel alpha2/delta subunit 1 (cluster #1 of 4) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CA2D1-4-E Voltage-gated calcium channel alpha2/delta subunit 1 (cluster #4 of 4) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CA2D2-1-E Voltage-gated calcium channel alpha2/delta subunit 2 (cluster #1 of 2) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CA2D3-1-E Voltage-gated calcium channel alpha2/delta subunit 3 (cluster #1 of 2) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CA2D4-1-E Voltage-gated calcium channel alpha2/delta-4 subunit (cluster #1 of 2) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH1-10-E Carbonic anhydrase I (cluster #10 of 12) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH1-2-E Carbonic anhydrase I (cluster #2 of 12) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH10-1-E Carbonic anhydrase-related protein 10 (cluster #1 of 2) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH11-1-E Carbonic anhydrase-related protein 2 (cluster #1 of 2) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH13-7-E Carbonic anhydrase XIII (cluster #7 of 7) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH14-3-E Carbonic anhydrase XIV (cluster #3 of 8) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH14-8-E Carbonic anhydrase XIV (cluster #8 of 8) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH2-11-E Carbonic anhydrase II (cluster #11 of 15) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH2-2-E Carbonic anhydrase II (cluster #2 of 15) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH4-5-E Carbonic anhydrase IV (cluster #5 of 16) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH4-6-E Carbonic anhydrase IV (cluster #6 of 16) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH5A-10-E Carbonic anhydrase VA (cluster #10 of 10) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH5A-5-E Carbonic anhydrase VA (cluster #5 of 10) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH5B-8-E Carbonic anhydrase VB (cluster #8 of 9) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH5B-9-E Carbonic anhydrase VB (cluster #9 of 9) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH6-1-E Carbonic anhydrase VI (cluster #1 of 8) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH6-5-E Carbonic anhydrase VI (cluster #5 of 8) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH8-1-E Carbonic anhydrase-related protein 8 (cluster #1 of 2) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH9-10-E Carbonic anhydrase IX (cluster #10 of 11) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH9-5-E Carbonic anhydrase IX (cluster #5 of 11) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CCR2-1-E C-C chemokine receptor type 2 (cluster #1 of 1) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CD38-1-E Lymphocyte differentiation antigen CD38 (cluster #1 of 1) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CHLE-5-E Butyrylcholinesterase (cluster #5 of 7) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CNCG-1-E Phosphodiesterase 6H (cluster #1 of 1) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CNR1-1-E Cannabinoid CB1 receptor (cluster #1 of 5) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CNR2-1-E Cannabinoid CB2 receptor (cluster #1 of 3) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CNRG-1-E Phosphodiesterase 6G (cluster #1 of 1) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
COX2-1-E Cytochrome c oxidase subunit 2 (cluster #1 of 1) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CP121-1-B Cytochrome P450 121 (cluster #1 of 1) Bacteria 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CYNT-2-B Carbonic anhydrase (cluster #2 of 3) Bacteria 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
D5HSX5-1-B Extended-spectrum beta-lactamase PER-6 (cluster #1 of 1) Bacteria 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
DAPE-1-B Succinyl-diaminopimelate desuccinylase (cluster #1 of 1) Bacteria 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
DHB3-1-E Estradiol 17-beta-dehydrogenase 3 (cluster #1 of 4) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
DHB3-3-E Estradiol 17-beta-dehydrogenase 3 (cluster #3 of 4) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
DHI1-2-E 11-beta-hydroxysteroid dehydrogenase 1 (cluster #2 of 3) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
DHI2-1-E 11-beta-hydroxysteroid dehydrogenase 2 (cluster #1 of 2) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
DRD2-16-E Dopamine D2 receptor (cluster #16 of 24) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
DRD2-18-E Dopamine D2 receptor (cluster #18 of 24) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
DRD2-6-E Dopamine D2 receptor (cluster #6 of 24) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
DRD2-7-E Dopamine D2 receptor (cluster #7 of 24) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
DUOX2-2-E Thyroid oxidase 2 (cluster #2 of 2) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
DUS1-2-E Dual specificity protein phosphatase 1 (cluster #2 of 2) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
DYR-1-B Dihydrofolate reductase (cluster #1 of 4) Bacteria 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
DYR-1-F Dihydrofolate reductase (cluster #1 of 1) Fungi 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
DYR-3-B Dihydrofolate reductase (cluster #3 of 4) Bacteria 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
DYR1-1-B Dihydrofolate reductase type 1 (cluster #1 of 1) Bacteria 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
EBP-1-E 3-beta-hydroxysteroid-delta(8),delta(7)-isomerase (cluster #1 of 1) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ECE2-1-E Endothelin-converting enzyme 2 (cluster #1 of 1) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ECR-2-E Ecdysone receptor (cluster #2 of 2) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
EDNRA-3-E Endothelin receptor ET-A (cluster #3 of 3) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
EGFR-1-E Epidermal growth factor receptor erbB1 (cluster #1 of 4) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
EGLN1-2-E Egl nine homolog 1 (cluster #2 of 2) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ERBB2-1-E Receptor protein-tyrosine kinase erbB-2 (cluster #1 of 3) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ERG1-1-E Squalene monooxygenase (cluster #1 of 3) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ERG2-2-F C-8 sterol isomerase (cluster #2 of 2) Fungi 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ERR1-1-E Estrogen-related receptor alpha (cluster #1 of 1) Eukaryotes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ERR2-1-E Estrogen-related receptor beta (cluster #1 of 1) Eukaryotes 1 Annotations Catalogs SMILES