UCSF

Vitas-M BB

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

Binding 10μM Targets with Highest Number of Available Compounds (805 in total)

Name (Uniprot) Swissprot ChEMBL Description Size Browse Download (Annotations)
CAH2_HUMAN P00918 CHEMBL205 Carbonic anhydrase II 56 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH1_HUMAN P00915 CHEMBL261 Carbonic anhydrase I 46 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH9_HUMAN Q16790 CHEMBL3594 Carbonic anhydrase IX 43 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH12_HUMAN O43570 CHEMBL3242 Carbonic anhydrase XII 41 Annotations Catalogs SMILES SDF Mol2 Flexibase
KCNH2_HUMAN Q12809 CHEMBL240 HERG 39 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH6_HUMAN P23280 CHEMBL3025 Carbonic anhydrase VI 30 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH4_HUMAN P22748 CHEMBL3729 Carbonic anhydrase IV 29 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH7_HUMAN P43166 CHEMBL2326 Carbonic anhydrase VII 28 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH14_HUMAN Q9ULX7 CHEMBL3510 Carbonic anhydrase XIV 26 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH5A_HUMAN P35218 CHEMBL4789 Carbonic anhydrase VA 24 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT1A_RAT P19327 CHEMBL273 Serotonin 1a (5-HT1a) receptor 23 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH5B_HUMAN Q9Y2D0 CHEMBL3969 Carbonic anhydrase VB 22 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH3_HUMAN P07451 CHEMBL2885 Carbonic anhydrase III 21 Annotations Catalogs SMILES SDF Mol2 Flexibase
AOFB_HUMAN P27338 CHEMBL2039 Monoamine oxidase B 20 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH15_MOUSE Q99N23 CHEMBL5973 Carbonic anhydrase 15 20 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADA2B_RAT P19328 CHEMBL266 Alpha-2b adrenergic receptor 19 Annotations Catalogs SMILES SDF Mol2 Flexibase
PGH1_HUMAN P23219 CHEMBL221 Cyclooxygenase-1 19 Annotations Catalogs SMILES SDF Mol2 Flexibase
PGH2_HUMAN P35354 CHEMBL230 Cyclooxygenase-2 19 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z104304 Z104304 CHEMBL1907610 Adrenergic receptor alpha-1 19 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT2A_RAT P14842 CHEMBL322 Serotonin 2a (5-HT2a) receptor 17 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADA2A_RAT P22909 CHEMBL327 Alpha-2a adrenergic receptor 17 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADA2C_RAT P22086 CHEMBL314 Alpha-2c adrenergic receptor 17 Annotations Catalogs SMILES SDF Mol2 Flexibase
EST1_HUMAN P23141 CHEMBL2265 Acyl coenzyme A:cholesterol acyltransferase 17 Annotations Catalogs SMILES SDF Mol2 Flexibase
HRH1_HUMAN P35367 CHEMBL231 Histamine H1 receptor 17 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT1B_RAT P28564 CHEMBL3459 Serotonin 1b (5-HT1b) receptor 16 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT3A_HUMAN P46098 CHEMBL1899 Serotonin 3a (5-HT3a) receptor 14 Annotations Catalogs SMILES SDF Mol2 Flexibase
DRD2_RAT P61169 CHEMBL339 Dopamine D2 receptor 14 Annotations Catalogs SMILES SDF Mol2 Flexibase
GSK3B_HUMAN P49841 CHEMBL262 Glycogen synthase kinase-3 beta 14 Annotations Catalogs SMILES SDF Mol2 Flexibase
MGLL_HUMAN Q99685 CHEMBL4191 Monoglyceride lipase 14 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT2C_RAT P08909 CHEMBL324 Serotonin 2c (5-HT2c) receptor 13 Annotations Catalogs SMILES SDF Mol2 Flexibase
A3EZI9_9HEPC A3EZI9 CHEMBL4893 Hepatitis C virus NS3 protease/helicase 13 Annotations Catalogs SMILES SDF Mol2 Flexibase
AOFA_HUMAN P21397 CHEMBL1951 Monoamine oxidase A 13 Annotations Catalogs SMILES SDF Mol2 Flexibase
SC6A3_RAT P23977 CHEMBL338 Dopamine transporter 13 Annotations Catalogs SMILES SDF Mol2 Flexibase
AA3R_HUMAN P33765 CHEMBL256 Adenosine A3 receptor 12 Annotations Catalogs SMILES SDF Mol2 Flexibase
CA2D1_MOUSE O08532 CHEMBL4676 Voltage-gated calcium channel alpha2/delta subunit 1 12 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH13_MOUSE Q9D6N1 CHEMBL2186 Carbonic anhydrase XIII 12 Annotations Catalogs SMILES SDF Mol2 Flexibase
SGMR1_HUMAN Q99720 CHEMBL287 Sigma opioid receptor 12 Annotations Catalogs SMILES SDF Mol2 Flexibase
TYRO_AGABI O42713 CHEMBL3318 Tyrosinase 12 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z104302 Z104302 CHEMBL1907608 Glutamate NMDA receptor 12 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT2B_RAT P30994 CHEMBL323 Serotonin 2b (5-HT2b) receptor 11 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT3B_HUMAN O95264 CHEMBL3895 Serotonin 3b (5-HT3b) receptor 11 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT3C_HUMAN Q8WXA8 CHEMBL4795 Serotonin 3c (5-HT3c) receptor 11 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT3D_HUMAN Q70Z44 CHEMBL4673 Serotonin 3d (5-HT3d) receptor 11 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT3E_HUMAN A5X5Y0 CHEMBL3812 Serotonin 3e (5-HT3e) receptor 11 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACES_HUMAN P22303 CHEMBL220 Acetylcholinesterase 11 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACE_HUMAN P12821 CHEMBL1808 Angiotensin-converting enzyme 11 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADA1A_HUMAN P35348 CHEMBL229 Alpha-1a adrenergic receptor 11 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH4_BOVIN Q95323 CHEMBL281 Carbonic anhydrase IV 11 Annotations Catalogs SMILES SDF Mol2 Flexibase
NOS2_HUMAN P35228 CHEMBL4481 Nitric oxide synthase, inducible 11 Annotations Catalogs SMILES SDF Mol2 Flexibase
Q5AJ71_CANAL Q5AJ71 CHEMBL5337 Carbonic anhydrase 11 Annotations Catalogs SMILES SDF Mol2 Flexibase
SCN1A_HUMAN P35498 CHEMBL1845 Sodium channel protein type I alpha subunit 11 Annotations Catalogs SMILES SDF Mol2 Flexibase
SCN2A_HUMAN Q99250 CHEMBL4187 Sodium channel protein type II alpha subunit 11 Annotations Catalogs SMILES SDF Mol2 Flexibase
SCN3A_HUMAN Q9NY46 CHEMBL5163 Sodium channel protein type III alpha subunit 11 Annotations Catalogs SMILES SDF Mol2 Flexibase
SCN8A_HUMAN Q9UQD0 CHEMBL5202 Sodium channel protein type VIII alpha subunit 11 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT1D_RAT P28565 CHEMBL5450 Serotonin 1d (5-HT1d) receptor 10 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT1F_RAT P30940 CHEMBL4646 Serotonin 1f (5-HT1f) receptor 10 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT6R_HUMAN P50406 CHEMBL3371 Serotonin 6 (5-HT6) receptor 10 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADA2A_HUMAN P08913 CHEMBL1867 Alpha-2a adrenergic receptor 10 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADA2C_HUMAN P18825 CHEMBL1916 Alpha-2c adrenergic receptor 10 Annotations Catalogs SMILES SDF Mol2 Flexibase
ALDR_RAT P07943 CHEMBL2622 Aldose reductase 10 Annotations Catalogs SMILES SDF Mol2 Flexibase
DRD2_HUMAN P14416 CHEMBL217 Dopamine D2 receptor 10 Annotations Catalogs SMILES SDF Mol2 Flexibase
NOS1_HUMAN P29475 CHEMBL3568 Nitric-oxide synthase, brain 10 Annotations Catalogs SMILES SDF Mol2 Flexibase
SC6A2_HUMAN P23975 CHEMBL222 Norepinephrine transporter 10 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z104301 Z104301 CHEMBL1907607 GABA-A receptor; anion channel 10 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT2C_HUMAN P28335 CHEMBL225 Serotonin 2c (5-HT2c) receptor 9 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADA1B_HUMAN P35368 CHEMBL232 Alpha-1b adrenergic receptor 9 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADA1D_HUMAN P25100 CHEMBL223 Alpha-1d adrenergic receptor 9 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADA2B_HUMAN P18089 CHEMBL1942 Alpha-2b adrenergic receptor 9 Annotations Catalogs SMILES SDF Mol2 Flexibase
B5SU02_9CNID B5SU02 CHEMBL1075028 Alpha carbonic anhydrase 9 Annotations Catalogs SMILES SDF Mol2 Flexibase
C0IX24_9CNID C0IX24 CHEMBL1649055 Carbonic anhydrase 9 Annotations Catalogs SMILES SDF Mol2 Flexibase
DRD3_HUMAN P35462 CHEMBL234 Dopamine D3 receptor 9 Annotations Catalogs SMILES SDF Mol2 Flexibase
ESR1_HUMAN P03372 CHEMBL206 Estrogen receptor alpha 9 Annotations Catalogs SMILES SDF Mol2 Flexibase
NOS3_HUMAN P29474 CHEMBL4803 Nitric-oxide synthase, endothelial 9 Annotations Catalogs SMILES SDF Mol2 Flexibase
Q9WTR4_RAT Q9WTR4 CHEMBL304 Norepinephrine transporter 9 Annotations Catalogs SMILES SDF Mol2 Flexibase
SC6A4_HUMAN P31645 CHEMBL228 Serotonin transporter 9 Annotations Catalogs SMILES SDF Mol2 Flexibase
SC6A4_RAT P31652 CHEMBL313 Serotonin transporter 9 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT1A_HUMAN P08908 CHEMBL214 Serotonin 1a (5-HT1a) receptor 8 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACHA4_RAT P09483 CHEMBL307 Neuronal acetylcholine receptor protein alpha-4 subunit 8 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACHA7_RAT Q05941 CHEMBL4980 Neuronal acetylcholine receptor protein alpha-7 subunit 8 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADRB2_HUMAN P07550 CHEMBL210 Beta-2 adrenergic receptor 8 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH13_HUMAN Q8N1Q1 CHEMBL3912 Carbonic anhydrase XIII 8 Annotations Catalogs SMILES SDF Mol2 Flexibase
CP19A_HUMAN P11511 CHEMBL1978 Cytochrome P450 19A1 8 Annotations Catalogs SMILES SDF Mol2 Flexibase
ESR2_HUMAN Q92731 CHEMBL242 Estrogen receptor beta 8 Annotations Catalogs SMILES SDF Mol2 Flexibase
Y1284_MYCTU P64797 CHEMBL5631 Uncharacterized protein Rv1284/MT1322 8 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50597 Z50597 CHEMBL376 Rattus norvegicus 8 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT1D_HUMAN P28221 CHEMBL1983 Serotonin 1d (5-HT1d) receptor 7 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT2A_HUMAN P28223 CHEMBL224 Serotonin 2a (5-HT2a) receptor 7 Annotations Catalogs SMILES SDF Mol2 Flexibase
AA1R_RAT P25099 CHEMBL318 Adenosine A1 receptor 7 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACH10_RAT Q9JLB5 CHEMBL3461 Neuronal acetylcholine receptor protein alpha-10 subunit 7 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACHA3_RAT P04757 CHEMBL3818 Neuronal acetylcholine receptor protein alpha-3 subunit 7 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACHA7_HUMAN P36544 CHEMBL2492 Neuronal acetylcholine receptor protein alpha-7 subunit 7 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACHB4_RAT P12392 CHEMBL2658 Neuronal acetylcholine receptor protein beta-4 subunit 7 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADA1A_BOVIN P18130 CHEMBL4892 Alpha-1a adrenergic receptor 7 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADRB1_HUMAN P08588 CHEMBL213 Beta-1 adrenergic receptor 7 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH_METTE P40881 CHEMBL3932 Carbonic anhydrase 7 Annotations Catalogs SMILES SDF Mol2 Flexibase
CHLE_HUMAN P06276 CHEMBL1914 Butyrylcholinesterase 7 Annotations Catalogs SMILES SDF Mol2 Flexibase
CYNT_HELPY O24855 CHEMBL4211 Carbonic anhydrase 1 7 Annotations Catalogs SMILES SDF Mol2 Flexibase
DRD1_RAT P18901 CHEMBL265 Dopamine D1 receptor 7 Annotations Catalogs SMILES SDF Mol2 Flexibase
EST2_HUMAN O00748 CHEMBL3180 Carboxylesterase 2 7 Annotations Catalogs SMILES SDF Mol2 Flexibase
GSK3A_HUMAN P49840 CHEMBL2850 Glycogen synthase kinase-3 alpha 7 Annotations Catalogs SMILES SDF Mol2 Flexibase
LOX5_RAT P12527 CHEMBL312 Arachidonate 5-lipoxygenase 7 Annotations Catalogs SMILES SDF Mol2 Flexibase
MIF_HUMAN P14174 CHEMBL2085 Macrophage migration inhibitory factor 7 Annotations Catalogs SMILES SDF Mol2 Flexibase
NISCH_HUMAN Q9Y2I1 CHEMBL3923 Nischarin 7 Annotations Catalogs SMILES SDF Mol2 Flexibase
PGH1_SHEEP P05979 CHEMBL2949 Cyclooxygenase-1 7 Annotations Catalogs SMILES SDF Mol2 Flexibase
Q965D7_PLAFA Q965D7 CHEMBL4512 Fatty acid synthase 7 Annotations Catalogs SMILES SDF Mol2 Flexibase
S22A6_MOUSE Q8VC69 CHEMBL5653 Solute carrier family 22 member 6 7 Annotations Catalogs SMILES SDF Mol2 Flexibase
SC6A3_HUMAN Q01959 CHEMBL238 Dopamine transporter 7 Annotations Catalogs SMILES SDF Mol2 Flexibase
XDH_HUMAN P47989 CHEMBL1929 Xanthine dehydrogenase 7 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACHB2_RAT P12390 CHEMBL3001 Neuronal acetylcholine receptor protein beta-2 subunit 6 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADA2A_BOVIN Q28838 CHEMBL4744 Alpha-2a adrenergic receptor 6 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADRB1_RAT P18090 CHEMBL3252 Beta-1 adrenergic receptor 6 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADRB2_CANFA P54833 CHEMBL2289 Beta-2 adrenergic receptor 6 Annotations Catalogs SMILES SDF Mol2 Flexibase
ALDR_BOVIN P16116 CHEMBL3081 Aldose reductase 6 Annotations Catalogs SMILES SDF Mol2 Flexibase
ANDR_HUMAN P10275 CHEMBL1871 Androgen Receptor 6 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAN_YEAST P53615 CHEMBL5931 Carbonic anhydrase 6 Annotations Catalogs SMILES SDF Mol2 Flexibase
CDK1_HUMAN P06493 CHEMBL308 Cyclin-dependent kinase 1 6 Annotations Catalogs SMILES SDF Mol2 Flexibase
HCAR2_RAT Q80Z39 CHEMBL4731 HM74 nicotinic acid GPCR 6 Annotations Catalogs SMILES SDF Mol2 Flexibase
HRH1_RAT P31390 CHEMBL4701 Histamine H1 receptor 6 Annotations Catalogs SMILES SDF Mol2 Flexibase
LOX5_HUMAN P09917 CHEMBL215 Arachidonate 5-lipoxygenase 6 Annotations Catalogs SMILES SDF Mol2 Flexibase
PARP1_HUMAN P09874 CHEMBL3105 Poly [ADP-ribose] polymerase-1 6 Annotations Catalogs SMILES SDF Mol2 Flexibase
PGH1_RAT Q63921 CHEMBL4042 Cyclooxygenase-1 6 Annotations Catalogs SMILES SDF Mol2 Flexibase
PRGR_HUMAN P06401 CHEMBL208 Progesterone receptor 6 Annotations Catalogs SMILES SDF Mol2 Flexibase
Q2PCB5_DICLA Q2PCB5 CHEMBL1795125 Carbonic anhydrase 6 Annotations Catalogs SMILES SDF Mol2 Flexibase
Q63380_RAT Q63380 CHEMBL6184 Transporter 6 Annotations Catalogs SMILES SDF Mol2 Flexibase
Q72547_9HIV1 Q72547 CHEMBL247 Human immunodeficiency virus type 1 reverse transcriptase 6 Annotations Catalogs SMILES SDF Mol2 Flexibase
Q7ZJM1_9HIV1 Q7ZJM1 CHEMBL3471 Human immunodeficiency virus type 1 integrase 6 Annotations Catalogs SMILES SDF Mol2 Flexibase
Q965D6_PLAFA Q965D6 CHEMBL4513 3-oxoacyl-acyl-carrier protein reductase 6 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT1B_HUMAN P28222 CHEMBL1898 Serotonin 1b (5-HT1b) receptor 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT1E_HUMAN P28566 CHEMBL2182 Serotonin 1e (5-HT1e) receptor 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT3A_RAT P35563 CHEMBL2411 Serotonin 3a (5-HT3a) receptor 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT3B_RAT Q9JJ16 CHEMBL3458 Serotonin 3b (5-HT3b) receptor 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT7R_HUMAN P34969 CHEMBL3155 Serotonin 7 (5-HT7) receptor 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
AA2AR_HUMAN P29274 CHEMBL251 Adenosine A2a receptor 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
AA2AR_RAT P30543 CHEMBL302 Adenosine A2a receptor 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
ABCG2_HUMAN Q9UNQ0 CHEMBL5393 ATP-binding cassette sub-family G member 2 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACHA2_RAT P12389 CHEMBL2584 Neuronal acetylcholine receptor protein alpha-2 subunit 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACHA9_RAT P43144 CHEMBL2585 Neuronal acetylcholine receptor protein alpha-9 subunit 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACHB2_HUMAN P17787 CHEMBL1883 Neuronal acetylcholine receptor protein beta-2 subunit 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACM2_HUMAN P08172 CHEMBL211 Muscarinic acetylcholine receptor M2 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADA1A_RAT P43140 CHEMBL319 Alpha-1a adrenergic receptor 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADA1B_RAT P15823 CHEMBL315 Alpha-1b adrenergic receptor 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
AMPM_ECOLI P0AE18 CHEMBL3423 Methionine aminopeptidase 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
ARY1_HUMAN P18440 CHEMBL5101 Arylamine N-acetyltransferase 1 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAC1C_RAT P22002 CHEMBL3762 Voltage-gated L-type calcium channel alpha-1C subunit 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
CHLE_HORSE P81908 CHEMBL5763 Cholinesterase 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
CP1B1_HUMAN Q16678 CHEMBL4878 Cytochrome P450 1B1 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
DHB3_HUMAN P37058 CHEMBL4234 Estradiol 17-beta-dehydrogenase 3 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
DRD1_HUMAN P21728 CHEMBL2056 Dopamine D1 receptor 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
DRD3_RAT P19020 CHEMBL3138 Dopamine D3 receptor 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
DRD4_HUMAN P21917 CHEMBL219 Dopamine D4 receptor 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
I23O1_HUMAN P14902 CHEMBL4685 Indoleamine 2,3-dioxygenase 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
NMDZ1_HUMAN Q05586 CHEMBL2015 Glutamate (NMDA) receptor subunit zeta 1 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
NMDZ1_RAT P35439 CHEMBL330 Glutamate (NMDA) receptor subunit zeta 1 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
OPRM_RAT P33535 CHEMBL270 Mu opioid receptor 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
P96878_MYCTU P96878 CHEMBL5767 PROBABLE TRANSMEMBRANE CARBONIC ANHYDRASE (CARBONATE DEHYDRATASE) (CARBONIC DEHYDRATASE) 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
PGH1_BOVIN O62664 CHEMBL2860 Cyclooxygenase-1 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
PGH2_BOVIN O62698 CHEMBL3331 Cyclooxygenase-2 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
PGH2_RAT P35355 CHEMBL2977 Cyclooxygenase-2 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
PGH2_SHEEP P79208 CHEMBL4102 Cyclooxygenase-2 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
PPARG_HUMAN P37231 CHEMBL235 Peroxisome proliferator-activated receptor gamma 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
PTN1_HUMAN P18031 CHEMBL335 Protein-tyrosine phosphatase 1B 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
Q965D5_PLAFA Q965D5 CHEMBL4150 Enoyl-acyl-carrier protein reductase 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
SC6A3_MOUSE Q61327 CHEMBL2799 Dopamine transporter 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z104283 Z104283 CHEMBL1907589 Neuronal acetylcholine receptor; alpha4/beta2 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT3B_MOUSE Q9JHJ5 CHEMBL3781 Serotonin 3b (5-HT3b) receptor 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT4R_HUMAN Q13639 CHEMBL1875 Serotonin 4 (5-HT4) receptor 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
A4_HUMAN P05067 CHEMBL2487 Beta amyloid A4 protein 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACES_ELEEL O42275 CHEMBL4078 Acetylcholinesterase 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACHA3_HUMAN P32297 CHEMBL3068 Neuronal acetylcholine receptor protein alpha-3 subunit 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACHA5_RAT P20420 CHEMBL4960 Neuronal acetylcholine receptor protein alpha-5 subunit 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACHA6_RAT P43143 CHEMBL4747 Neuronal acetylcholine receptor protein alpha-6 subunit 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACHA_RAT P25108 CHEMBL3599 Acetylcholine receptor protein alpha chain 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACHB3_RAT P12391 CHEMBL4568 Neuronal acetylcholine receptor protein beta-3 subunit 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACHB_RAT P25109 CHEMBL2666 Acetylcholine receptor protein beta chain 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACM1_HUMAN P11229 CHEMBL216 Muscarinic acetylcholine receptor M1 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADA1D_RAT P23944 CHEMBL326 Alpha-1d adrenergic receptor 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADCY2_RAT P26769 CHEMBL2958 Adenylate cyclase type II 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADCY3_RAT P21932 CHEMBL4864 Adenylate cyclase type III 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADCY4_RAT P26770 CHEMBL2879 Adenylate cyclase type IV 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADCY5_RAT Q04400 CHEMBL2880 Adenylate cyclase type V 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADCY6_RAT Q03343 CHEMBL2975 Adenylate cyclase type VI 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADCY8_RAT P40146 CHEMBL3082 Adenylate cyclase type VIII 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
AGTR1_HUMAN P30556 CHEMBL227 Angiotensin II type 1 receptor 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
AOFA_RAT P21396 CHEMBL3358 Monoamine oxidase A 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
AOFB_RAT P19643 CHEMBL2993 Monoamine oxidase B 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
ATP4A_HUMAN P20648 CHEMBL1802 Potassium-transporting ATPase alpha chain 1 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
ATP4B_HUMAN P51164 CHEMBL5207 Potassium-transporting ATPase beta chain 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
CCNB1_HUMAN P14635 CHEMBL2412 G2/mitotic-specific cyclin B1 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
CCNB2_HUMAN O95067 CHEMBL3723 G2/mitotic-specific cyclin B2 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
CCNB3_HUMAN Q8WWL7 CHEMBL3606 G2/mitotic-specific cyclin B3 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
CYSP_TRYCR P25779 CHEMBL3563 Cruzipain 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
GBRA1_HUMAN P14867 CHEMBL1962 GABA receptor alpha-1 subunit 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
GBRA2_HUMAN P47869 CHEMBL4956 GABA receptor alpha-2 subunit 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
GBRA3_HUMAN P34903 CHEMBL3026 GABA receptor alpha-3 subunit 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
GBRA4_HUMAN P48169 CHEMBL2472 GABA receptor alpha-4 subunit 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
GBRA5_HUMAN P31644 CHEMBL5112 GABA receptor alpha-5 subunit 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
GBRA6_HUMAN Q16445 CHEMBL2579 GABA receptor alpha-6 subunit 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
GYRA_ECOLI P0AES4 CHEMBL1858 DNA gyrase subunit A 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
GYRB_ECOLI P0AES6 CHEMBL1826 DNA gyrase subunit B 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
HCAR2_HUMAN Q8TDS4 CHEMBL3785 Nicotinic acid receptor 1 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
LIMK1_HUMAN P53667 CHEMBL3836 LIM domain kinase 1 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
LOX12_HUMAN P18054 CHEMBL3687 Arachidonate 12-lipoxygenase 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
LOX15_HUMAN P16050 CHEMBL2903 Arachidonate 15-lipoxygenase 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
NMD3A_HUMAN Q8TCU5 CHEMBL4787 Glutamate [NMDA] receptor subunit 3A 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
NMD3B_HUMAN O60391 CHEMBL2913 Glutamate [NMDA] receptor subunit 3B 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
NMDE1_HUMAN Q12879 CHEMBL1972 Glutamate [NMDA] receptor subunit epsilon 1 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
NMDE2_HUMAN Q13224 CHEMBL1904 Glutamate [NMDA] receptor subunit epsilon 2 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
NMDE3_HUMAN Q14957 CHEMBL4109 Glutamate [NMDA] receptor subunit epsilon 3 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
NMDE4_HUMAN O15399 CHEMBL2591 Glutamate [NMDA] receptor subunit epsilon 4 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
NOX4_HUMAN Q9NPH5 CHEMBL1250375 NADPH oxidase 4 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
OXDA_HUMAN P14920 CHEMBL5485 D-amino-acid oxidase 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
P90584_PLAFA P90584 CHEMBL4090 Protein kinase Pfmrk 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
PARC_STAAU P0C1U9 CHEMBL4088 Topoisomerase IV subunit A 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
PPARA_HUMAN Q07869 CHEMBL239 Peroxisome proliferator-activated receptor alpha 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
PPARG_RAT O88275 CHEMBL4797 Peroxisome proliferator-activated receptor gamma 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
Q3I4V7_CRYNV Q3I4V7 CHEMBL1697676 Carbonic anhydrase 2 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
SC6A2_MOUSE O55192 CHEMBL2370 Norepinephrine transporter 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
TRPA1_HUMAN O75762 CHEMBL6007 Transient receptor potential cation channel subfamily A member 1 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
XDH_BOVIN P80457 CHEMBL3649 Xanthine dehydrogenase 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z104288 Z104288 CHEMBL1907594 Neuronal acetylcholine receptor; alpha3/beta4 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z104294 Z104294 CHEMBL1907600 Cyclin-dependent kinase 5/CDK5 activator 1 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT2B_HUMAN P41595 CHEMBL1833 Serotonin 2b (5-HT2b) receptor 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT3A_MOUSE P23979 CHEMBL4972 Serotonin 3a (5-HT3a) receptor 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT4R_RAT Q62758 CHEMBL4317 Serotonin 4 (5-HT4) receptor 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT5A_MOUSE P30966 CHEMBL3597 Serotonin 5a (5-HT5a) receptor 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
AA1R_HUMAN P30542 CHEMBL226 Adenosine A1 receptor 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
AA2BR_HUMAN P29275 CHEMBL255 Adenosine A2b receptor 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACES_TORCA P04058 CHEMBL4780 Acetylcholinesterase 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACHA4_HUMAN P43681 CHEMBL1882 Neuronal acetylcholine receptor protein alpha-4 subunit 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACHB4_HUMAN P30926 CHEMBL3002 Neuronal acetylcholine receptor protein beta-4 subunit 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACHD_TORCA P02718 CHEMBL3916 Acetylcholine receptor protein delta chain 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACM1_RAT P08482 CHEMBL276 Muscarinic acetylcholine receptor M1 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACM3_HUMAN P20309 CHEMBL245 Muscarinic acetylcholine receptor M3 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACM4_HUMAN P08173 CHEMBL1821 Muscarinic acetylcholine receptor M4 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACM5_HUMAN P08912 CHEMBL2035 Muscarinic acetylcholine receptor M5 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
AGTRA_RAT P25095 CHEMBL329 Angiotensin II type 1a (AT-1a) receptor 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
AGTRB_RAT P29089 CHEMBL263 Angiotensin II type 1b (AT-1b) receptor 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
AK1C2_HUMAN P52895 CHEMBL5847 Aldo-keto reductase family 1 member C2 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
ALDR_HUMAN P15121 CHEMBL1900 Aldose reductase 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
AMPC_ECOLI P00811 CHEMBL2026 Beta-lactamase 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
AMPC_ENTCL P05364 CHEMBL2725 Beta-lactamase 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAC1C_HUMAN Q13936 CHEMBL1940 Voltage-gated L-type calcium channel alpha-1C subunit 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAC1D_HUMAN Q01668 CHEMBL4138 Voltage-gated L-type calcium channel alpha-1D subunit 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAC1F_HUMAN O60840 CHEMBL5593 Voltage-gated L-type calcium channel alpha-1F subunit 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAC1S_HUMAN Q13698 CHEMBL3805 Voltage-gated L-type calcium channel alpha-1S subunit 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH5A_MOUSE P23589 CHEMBL2330 Carbonic anhydrase VA 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH5B_MOUSE Q9QZA0 CHEMBL4634 Carbonic anhydrase VB 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
CBPA1_BOVIN P00730 CHEMBL3481 Carboxypeptidase A1 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
CDK6_HUMAN Q00534 CHEMBL2508 Cyclin-dependent kinase 6 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
CP51_MYCTU P0A512 CHEMBL5090 Lanosterol 14-alpha demethylase 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
CSK21_HUMAN P68400 CHEMBL3629 Casein kinase II alpha 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
CYNT_MYCTU O53573 CHEMBL6068 Carbonic anhydrase 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
DHB1_HUMAN P14061 CHEMBL3181 Estradiol 17-beta-dehydrogenase 1 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
DHI1_HUMAN P28845 CHEMBL4235 11-beta-hydroxysteroid dehydrogenase 1 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
DRD2_BOVIN P20288 CHEMBL3998 Dopamine D2 receptor 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
DRD4_RAT P30729 CHEMBL3361 Dopamine D4 receptor 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
DRD5_HUMAN P21918 CHEMBL1850 Dopamine D5 receptor 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
DRD5_RAT P25115 CHEMBL2281 Dopamine D5 receptor 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
EGFR_HUMAN P00533 CHEMBL203 Epidermal growth factor receptor erbB1 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
EST1_RABIT P12337 CHEMBL2623 Acyl coenzyme A:cholesterol acyltransferase 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
FABPL_RAT P02692 CHEMBL5738 Fatty acid-binding protein, liver 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
GABR1_HUMAN Q9UBS5 CHEMBL2064 GABA-B receptor 1 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
GABR1_RAT Q9Z0U4 CHEMBL2753 GABA-B receptor 1 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
GABR2_HUMAN O75899 CHEMBL5034 GABA-B receptor 2 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
GABR2_RAT O88871 CHEMBL4686 GABA-B receptor 2 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
GCR_HUMAN P04150 CHEMBL2034 Glucocorticoid receptor 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
HRH3_HUMAN Q9Y5N1 CHEMBL264 Histamine H3 receptor 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
LGUL_HUMAN Q04760 CHEMBL2424 Glyoxalase I 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
MDR1_HUMAN P08183 CHEMBL4302 P-glycoprotein 1 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
MET_HUMAN P08581 CHEMBL3717 Hepatocyte growth factor receptor 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
MPIP2_HUMAN P30305 CHEMBL4804 Dual specificity phosphatase Cdc25B 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
MRP1_HUMAN P33527 CHEMBL3004 Multidrug resistance-associated protein 1 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
MTR1A_HUMAN P48039 CHEMBL1945 Melatonin receptor 1A 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
MTR1B_HUMAN P49286 CHEMBL1946 Melatonin receptor 1B 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
NQO2_HUMAN P16083 CHEMBL3959 Quinone reductase 2 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
PDE4A_HUMAN P27815 CHEMBL254 Phosphodiesterase 4A 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
PDE4B_HUMAN Q07343 CHEMBL275 Phosphodiesterase 4B 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
PDE4C_HUMAN Q08493 CHEMBL291 Phosphodiesterase 4C 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
PDE4D_HUMAN Q08499 CHEMBL288 Phosphodiesterase 4D 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
PGH2_MOUSE Q05769 CHEMBL4321 Cyclooxygenase-2 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
PRIO_HUMAN P04156 CHEMBL4869 Prion protein 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
PTR1_LEIMA Q01782 CHEMBL6194 Pteridine reductase 1 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
Q72874_9HIV1 Q72874 CHEMBL243 Human immunodeficiency virus type 1 protease 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
Q862F3_BOVIN Q862F3 CHEMBL4262 Tubulin alpha chain 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
Q862L2_BOVIN Q862L2 CHEMBL3752 Tubulin alpha-1 chain 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
S22AK_MOUSE Q80UJ1 CHEMBL5269 Solute carrier family 22 member 20 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
SC6A1_HUMAN P30531 CHEMBL1903 GABA transporter 1 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
SC6A1_RAT P23978 CHEMBL4054 GABA transporter 1 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
SGMR1_RAT Q9R0C9 CHEMBL3602 Sigma opioid receptor 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
SRC_HUMAN P12931 CHEMBL267 Tyrosine-protein kinase SRC 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
TBB1_HUMAN Q9H4B7 CHEMBL1915 Tubulin beta-1 chain 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
TBB2B_BOVIN Q6B856 CHEMBL3394 Tubulin beta chain 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
THRB_HUMAN P00734 CHEMBL204 Thrombin 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
TRY1_HUMAN P07477 CHEMBL209 Trypsin I 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
TTHY_HUMAN P02766 CHEMBL3194 Transthyretin 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z104290 Z104290 CHEMBL1907596 Neuronal acetylcholine receptor; alpha4/beta2 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z104303 Z104303 CHEMBL1907609 Muscarinic acetylcholine receptor 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT2C_MOUSE P34968 CHEMBL3006 Serotonin 2c (5-HT2c) receptor 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT5A_HUMAN P47898 CHEMBL3426 Serotonin 5a (5-HT5a) receptor 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT7R_RAT P32305 CHEMBL3223 Serotonin 7 (5-HT7) receptor 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
6PGD_HUMAN P52209 CHEMBL3404 6-phosphogluconate dehydrogenase 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
A1E3K9_ECOLX A1E3K9 CHEMBL1075073 Beta-lactamase SCO-1 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
A8RR46_BACCS A8RR46 CHEMBL5439 Beta-lactamase 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
AA1R_BOVIN P28190 CHEMBL4975 Adenosine A1 receptor 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
AA2BR_RAT P29276 CHEMBL2592 Adenosine A2b receptor 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
AA3R_RAT P28647 CHEMBL3360 Adenosine A3 receptor 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACES_BOVIN P23795 CHEMBL4768 Acetylcholinesterase 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACES_RAT P37136 CHEMBL3199 Acetylcholinesterase 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACE_RAT P47820 CHEMBL2625 Angiotensin-converting enzyme 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACHA_TORCA P02710 CHEMBL3097 Acetylcholine receptor protein alpha chain 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACHB3_HUMAN Q05901 CHEMBL2586 Neuronal acetylcholine receptor protein beta-3 subunit 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACHB_TORCA P02712 CHEMBL3803 Acetylcholine receptor protein beta chain 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACHD_HUMAN Q07001 CHEMBL3011 Acetylcholine receptor protein delta chain 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACHG_TORCA P02714 CHEMBL4019 Acetylcholine receptor protein gamma chain 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACM2_RAT P10980 CHEMBL309 Muscarinic acetylcholine receptor M2 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADRB2_RAT P10608 CHEMBL3754 Beta-2 adrenergic receptor 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADRB3_HUMAN P13945 CHEMBL246 Beta-3 adrenergic receptor 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADRB3_RAT P26255 CHEMBL4031 Beta-3 adrenergic receptor 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
AK1A1_RAT P51635 CHEMBL3871 Aldehyde reductase 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
AK1C3_HUMAN P42330 CHEMBL4681 Aldo-keto-reductase family 1 member C3 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ALBU_BOVIN P02769 CHEMBL3728 Serum albumin 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ALDR_PIG P80276 CHEMBL4559 Aldose reductase 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
AOFA_BOVIN P21398 CHEMBL3254 Monoamine oxidase A 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ATP4A_PIG P19156 CHEMBL3919 Potassium-transporting ATPase alpha chain 1 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ATP4B_PIG P18434 CHEMBL2538 Potassium-transporting ATPase beta chain 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
BACE1_HUMAN P56817 CHEMBL4822 Beta-secretase 1 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
BLAC_STAAU P00807 CHEMBL4114 Beta-lactamase 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
BLAT_ECOLX P62593 CHEMBL2065 Beta-lactamase TEM 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
C11B2_HUMAN P19099 CHEMBL2722 Cytochrome P450 11B2 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
C3SLN2_ECOLX C3SLN2 CHEMBL1287603 DNA gyrase subunit B 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAC1D_RAT P27732 CHEMBL4132 Voltage-gated L-type calcium channel alpha-1D subunit 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
CASP3_HUMAN P42574 CHEMBL2334 Caspase-3 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
CBPA1_HUMAN P15085 CHEMBL2088 Carboxypeptidase A1 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
CBPA3_HUMAN P15088 CHEMBL2645 Mast cell carboxypeptidase A 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
CBPB1_HUMAN P15086 CHEMBL2552 Carboxypeptidase B 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
CBPB2_HUMAN Q96IY4 CHEMBL3419 Carboxypeptidase B2 isoform A 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
CBR1_HUMAN P16152 CHEMBL5586 Carbonyl reductase [NADPH] 1 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
CDK2_HUMAN P24941 CHEMBL301 Cyclin-dependent kinase 2 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
CLTR2_HUMAN Q9NS75 CHEMBL4330 Cysteinyl leukotriene receptor 2 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
CP17A_HUMAN P05093 CHEMBL3522 Cytochrome P450 17A1 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
CP19A_RAT P22443 CHEMBL3859 Cytochrome P450 19A1 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
CSK2B_HUMAN P67870 CHEMBL2358 Casein kinase II beta 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
D1MIX9_PSEAI D1MIX9 CHEMBL1250341 Beta-lactamase GES-13 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
D4A3N4_RAT D4A3N4 CHEMBL2679 Brain adenylate cyclase 1 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
DAPE_HAEIN P44514 CHEMBL1075192 Succinyl-diaminopimelate desuccinylase 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
DHB2_HUMAN P37059 CHEMBL2789 Estradiol 17-beta-dehydrogenase 2 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
DRD1_BOVIN Q95136 CHEMBL2967 Dopamine D1 receptor 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
DRTS_PLAFK P13922 CHEMBL1939 Dihydrofolate reductase 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
DYR_HUMAN P00374 CHEMBL202 Dihydrofolate reductase 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
DYR_PNECA P16184 CHEMBL1926 Dihydrofolate reductase 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
EGLN1_HUMAN Q9GZT9 CHEMBL5697 Egl nine homolog 1 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ERG1_RAT P52020 CHEMBL4241 Squalene monooxygenase 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ERR1_HUMAN P11474 CHEMBL3429 Estrogen-related receptor alpha 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ERR2_HUMAN O95718 CHEMBL3751 Estrogen-related receptor beta 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
FABP4_HUMAN P15090 CHEMBL2083 Fatty acid binding protein adipocyte 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
FABPH_HUMAN P05413 CHEMBL3344 Fatty acid binding protein muscle 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
FPPS_HUMAN P14324 CHEMBL1782 Farnesyl diphosphate synthase 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
FYN_HUMAN P06241 CHEMBL1841 Tyrosine-protein kinase FYN 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
G6PD_YEAST P11412 CHEMBL1075249 Glucose-6-phosphate 1-dehydrogenase 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
GASR_RAT P30553 CHEMBL3508 Cholecystokinin B receptor 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
GPR44_HUMAN Q9Y5Y4 CHEMBL5071 G protein-coupled receptor 44 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
GSTK1_HUMAN Q9Y2Q3 CHEMBL4491 Glutathione S-transferase kappa 1 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
GYRA_MYCTU Q07702 CHEMBL4165 DNA gyrase subunit A 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
HMDH_HUMAN P04035 CHEMBL402 HMG-CoA reductase 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
HMDH_RAT P51639 CHEMBL3247 HMG-CoA reductase 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
IKKB_HUMAN O14920 CHEMBL1991 Inhibitor of nuclear factor kappa B kinase beta subunit 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
KS6A3_HUMAN P51812 CHEMBL2345 Ribosomal protein S6 kinase alpha 3 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
LCK_HUMAN P06239 CHEMBL258 Tyrosine-protein kinase LCK 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
LEF_BACAN P15917 CHEMBL4372 Anthrax lethal factor 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
LKHA4_HUMAN P09960 CHEMBL4618 Leukotriene A4 hydrolase 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
LOX1_SOYBN P08170 CHEMBL4586 Seed lipoxygenase-1 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
LT4R1_HUMAN Q15722 CHEMBL3911 Leukotriene B4 receptor 1 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
MK14_HUMAN Q16539 CHEMBL260 MAP kinase p38 alpha 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
MTR1A_CHICK P49285 CHEMBL4555 Melatonin receptor 1A 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
MTR1B_CHICK P51050 CHEMBL4466 Melatonin receptor 1B 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
MTR1C_CHICK P49288 CHEMBL3196 Melatonin receptor 1C 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
NANH_CLOPE P10481 CHEMBL5189 Sialidase 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
NOS1_RAT P29476 CHEMBL3048 Nitric-oxide synthase, brain 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
O77823_PIG O77823 CHEMBL3333 Phosphodiesterase 4A 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
P97706_RAT P97706 CHEMBL4957 Sodium channel protein type VI alpha subunit 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
PDE10_HUMAN Q9Y233 CHEMBL4409 Phosphodiesterase 10A 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
PDE2A_HUMAN O00408 CHEMBL2652 Phosphodiesterase 2A 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
PERM_HUMAN P05164 CHEMBL2439 Myeloperoxidase 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
PIM1_HUMAN P11309 CHEMBL2147 Serine/threonine-protein kinase PIM1 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
PPARD_HUMAN Q03181 CHEMBL3979 Peroxisome proliferator-activated receptor delta 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
PPARG_MOUSE P37238 CHEMBL2459 Peroxisome proliferator-activated receptor gamma 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
PPBT_HUMAN P05186 CHEMBL5979 Alkaline phosphatase, tissue-nonspecific isozyme 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Q0GKD7_LEIDO Q0GKD7 CHEMBL3693 Farnesyl pyrophosphate synthase 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Q47245_ECOLX Q47245 CHEMBL1287602 DNA gyrase subunit A 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Q4U254_9ENTO Q4U254 CHEMBL2857 Human rhinovirus A protease 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Q864F1_PIG Q864F1 CHEMBL3634 Phosphodiesterase 5 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Q8CFM9_RAT Q8CFM9 CHEMBL3940 Adenylate cyclase type VII 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Q9JKC1_RAT Q9JKC1 CHEMBL3403 Butyrylcholinesterase 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Q9N1N9_HORSE Q9N1N9 CHEMBL5077 Butyrylcholinesterase 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
RARG_HUMAN P13631 CHEMBL2003 Retinoic acid receptor gamma 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
RXRA_RAT Q05343 CHEMBL4431 Retinoid X receptor alpha 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
SCN5A_RAT P15389 CHEMBL3866 Sodium channel protein type V alpha subunit 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
SCN9A_HUMAN Q15858 CHEMBL4296 Sodium channel protein type IX alpha subunit 2 Annotations Catalogs SMILES SDF Mol2 Flexibase