UCSF

Molcan

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

Binding 10μM Targets with Highest Number of Available Compounds (487 in total)

Name (Uniprot) Swissprot ChEMBL Description Size Browse Download (Annotations)
KCNH2_HUMAN Q12809 CHEMBL240 HERG 23 Annotations Catalogs SMILES SDF Mol2 Flexibase
HMDH_RAT P51639 CHEMBL3247 HMG-CoA reductase 22 Annotations Catalogs SMILES SDF Mol2 Flexibase
HMDH_HUMAN P04035 CHEMBL402 HMG-CoA reductase 19 Annotations Catalogs SMILES SDF Mol2 Flexibase
SC6A2_HUMAN P23975 CHEMBL222 Norepinephrine transporter 17 Annotations Catalogs SMILES SDF Mol2 Flexibase
SC6A3_HUMAN Q01959 CHEMBL238 Dopamine transporter 15 Annotations Catalogs SMILES SDF Mol2 Flexibase
SC6A4_HUMAN P31645 CHEMBL228 Serotonin transporter 13 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACE_HUMAN P12821 CHEMBL1808 Angiotensin-converting enzyme 12 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADA1A_RAT P43140 CHEMBL319 Alpha-1a adrenergic receptor 12 Annotations Catalogs SMILES SDF Mol2 Flexibase
DRD2_RAT P61169 CHEMBL339 Dopamine D2 receptor 11 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADA1A_HUMAN P35348 CHEMBL229 Alpha-1a adrenergic receptor 10 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADA1B_HUMAN P35368 CHEMBL232 Alpha-1b adrenergic receptor 10 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADA1D_HUMAN P25100 CHEMBL223 Alpha-1d adrenergic receptor 10 Annotations Catalogs SMILES SDF Mol2 Flexibase
DRD2_HUMAN P14416 CHEMBL217 Dopamine D2 receptor 9 Annotations Catalogs SMILES SDF Mol2 Flexibase
HRH1_HUMAN P35367 CHEMBL231 Histamine H1 receptor 9 Annotations Catalogs SMILES SDF Mol2 Flexibase
HRH1_RAT P31390 CHEMBL4701 Histamine H1 receptor 9 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT1A_HUMAN P08908 CHEMBL214 Serotonin 1a (5-HT1a) receptor 8 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT2A_HUMAN P28223 CHEMBL224 Serotonin 2a (5-HT2a) receptor 8 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT2A_RAT P14842 CHEMBL322 Serotonin 2a (5-HT2a) receptor 8 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT2C_HUMAN P28335 CHEMBL225 Serotonin 2c (5-HT2c) receptor 8 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACM2_HUMAN P08172 CHEMBL211 Muscarinic acetylcholine receptor M2 8 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACM3_HUMAN P20309 CHEMBL245 Muscarinic acetylcholine receptor M3 8 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACM4_HUMAN P08173 CHEMBL1821 Muscarinic acetylcholine receptor M4 8 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACM5_HUMAN P08912 CHEMBL2035 Muscarinic acetylcholine receptor M5 8 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT1A_RAT P19327 CHEMBL273 Serotonin 1a (5-HT1a) receptor 7 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACM1_HUMAN P11229 CHEMBL216 Muscarinic acetylcholine receptor M1 7 Annotations Catalogs SMILES SDF Mol2 Flexibase
AGTR1_HUMAN P30556 CHEMBL227 Angiotensin II type 1 receptor 7 Annotations Catalogs SMILES SDF Mol2 Flexibase
AGTRB_RAT P29089 CHEMBL263 Angiotensin II type 1b (AT-1b) receptor 7 Annotations Catalogs SMILES SDF Mol2 Flexibase
DRD1_HUMAN P21728 CHEMBL2056 Dopamine D1 receptor 7 Annotations Catalogs SMILES SDF Mol2 Flexibase
DRD1_RAT P18901 CHEMBL265 Dopamine D1 receptor 7 Annotations Catalogs SMILES SDF Mol2 Flexibase
DRD3_HUMAN P35462 CHEMBL234 Dopamine D3 receptor 7 Annotations Catalogs SMILES SDF Mol2 Flexibase
Q63380_RAT Q63380 CHEMBL6184 Transporter 7 Annotations Catalogs SMILES SDF Mol2 Flexibase
Q9WTR4_RAT Q9WTR4 CHEMBL304 Norepinephrine transporter 7 Annotations Catalogs SMILES SDF Mol2 Flexibase
SC6A3_RAT P23977 CHEMBL338 Dopamine transporter 7 Annotations Catalogs SMILES SDF Mol2 Flexibase
SC6A4_RAT P31652 CHEMBL313 Serotonin transporter 7 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT1B_RAT P28564 CHEMBL3459 Serotonin 1b (5-HT1b) receptor 6 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT2B_RAT P30994 CHEMBL323 Serotonin 2b (5-HT2b) receptor 6 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT2C_RAT P08909 CHEMBL324 Serotonin 2c (5-HT2c) receptor 6 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT6R_HUMAN P50406 CHEMBL3371 Serotonin 6 (5-HT6) receptor 6 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADA2A_HUMAN P08913 CHEMBL1867 Alpha-2a adrenergic receptor 6 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADA2A_RAT P22909 CHEMBL327 Alpha-2a adrenergic receptor 6 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADA2B_HUMAN P18089 CHEMBL1942 Alpha-2b adrenergic receptor 6 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADA2C_HUMAN P18825 CHEMBL1916 Alpha-2c adrenergic receptor 6 Annotations Catalogs SMILES SDF Mol2 Flexibase
AGTRA_RAT P25095 CHEMBL329 Angiotensin II type 1a (AT-1a) receptor 6 Annotations Catalogs SMILES SDF Mol2 Flexibase
ATP4A_HUMAN P20648 CHEMBL1802 Potassium-transporting ATPase alpha chain 1 6 Annotations Catalogs SMILES SDF Mol2 Flexibase
ATP4B_HUMAN P51164 CHEMBL5207 Potassium-transporting ATPase beta chain 6 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAC1C_RAT P22002 CHEMBL3762 Voltage-gated L-type calcium channel alpha-1C subunit 6 Annotations Catalogs SMILES SDF Mol2 Flexibase
DRD4_HUMAN P21917 CHEMBL219 Dopamine D4 receptor 6 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT2B_HUMAN P41595 CHEMBL1833 Serotonin 2b (5-HT2b) receptor 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
AA3R_HUMAN P33765 CHEMBL256 Adenosine A3 receptor 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACE_RAT P47820 CHEMBL2625 Angiotensin-converting enzyme 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADA2B_RAT P19328 CHEMBL266 Alpha-2b adrenergic receptor 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADA2C_RAT P22086 CHEMBL314 Alpha-2c adrenergic receptor 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
AOFB_HUMAN P27338 CHEMBL2039 Monoamine oxidase B 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
DRD3_RAT P19020 CHEMBL3138 Dopamine D3 receptor 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
PPARG_HUMAN P37231 CHEMBL235 Peroxisome proliferator-activated receptor gamma 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z104304 Z104304 CHEMBL1907610 Adrenergic receptor alpha-1 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT1D_RAT P28565 CHEMBL5450 Serotonin 1d (5-HT1d) receptor 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT7R_HUMAN P34969 CHEMBL3155 Serotonin 7 (5-HT7) receptor 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
A2RP81_CITFR A2RP81 CHEMBL5303 PER-2 beta-lactamase 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACES_HUMAN P22303 CHEMBL220 Acetylcholinesterase 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACM1_RAT P08482 CHEMBL276 Muscarinic acetylcholine receptor M1 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADA1A_BOVIN P18130 CHEMBL4892 Alpha-1a adrenergic receptor 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADRB1_RAT P18090 CHEMBL3252 Beta-1 adrenergic receptor 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
AGTR1_BOVIN P25104 CHEMBL3374 Angiotensin II type 1a (AT-1a) receptor 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
AGTR2_HUMAN P50052 CHEMBL4607 Angiotensin II type 2 (AT-2) receptor 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
AGTR2_RAT P35351 CHEMBL257 Angiotensin II type 2 (AT-2) receptor 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAC1D_RAT P27732 CHEMBL4132 Voltage-gated L-type calcium channel alpha-1D subunit 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
DRD4_RAT P30729 CHEMBL3361 Dopamine D4 receptor 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
DRD5_RAT P25115 CHEMBL2281 Dopamine D5 receptor 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
SCN1A_HUMAN P35498 CHEMBL1845 Sodium channel protein type I alpha subunit 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
SCN2A_HUMAN Q99250 CHEMBL4187 Sodium channel protein type II alpha subunit 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
SCN3A_HUMAN Q9NY46 CHEMBL5163 Sodium channel protein type III alpha subunit 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
SCN8A_HUMAN Q9UQD0 CHEMBL5202 Sodium channel protein type VIII alpha subunit 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
TOP1_HUMAN P11387 CHEMBL1781 DNA topoisomerase I 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT1A_MOUSE Q64264 CHEMBL3737 Serotonin 1a (5-HT1a) receptor 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT1F_RAT P30940 CHEMBL4646 Serotonin 1f (5-HT1f) receptor 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT3A_HUMAN P46098 CHEMBL1899 Serotonin 3a (5-HT3a) receptor 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT3A_MOUSE P23979 CHEMBL4972 Serotonin 3a (5-HT3a) receptor 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT3A_RAT P35563 CHEMBL2411 Serotonin 3a (5-HT3a) receptor 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT3B_RAT Q9JJ16 CHEMBL3458 Serotonin 3b (5-HT3b) receptor 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT4R_RAT Q62758 CHEMBL4317 Serotonin 4 (5-HT4) receptor 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT7R_RAT P32305 CHEMBL3223 Serotonin 7 (5-HT7) receptor 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACE2_HUMAN Q9BYF1 CHEMBL3736 Angiotensin-converting enzyme 2 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACES_BOVIN P23795 CHEMBL4768 Acetylcholinesterase 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACES_ELEEL O42275 CHEMBL4078 Acetylcholinesterase 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACES_RAT P37136 CHEMBL3199 Acetylcholinesterase 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACES_TORCA P04058 CHEMBL4780 Acetylcholinesterase 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACE_RABIT P12822 CHEMBL4074 Angiotensin-converting enzyme 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADA1D_RAT P23944 CHEMBL326 Alpha-1d adrenergic receptor 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
ANDR_HUMAN P10275 CHEMBL1871 Androgen Receptor 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
ANDR_RAT P15207 CHEMBL3072 Androgen Receptor 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH2_HUMAN P00918 CHEMBL205 Carbonic anhydrase II 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
CHLE_HORSE P81908 CHEMBL5763 Cholinesterase 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
CYSP_TRYCR P25779 CHEMBL3563 Cruzipain 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
D1MIX9_PSEAI D1MIX9 CHEMBL1250341 Beta-lactamase GES-13 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
DYR_HUMAN P00374 CHEMBL202 Dihydrofolate reductase 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
DYR_MOUSE P00375 CHEMBL4564 Dihydrofolate reductase 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
IMDH1_HUMAN P20839 CHEMBL1822 Inosine-5'-monophosphate dehydrogenase 1 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
IMDH2_HUMAN P12268 CHEMBL2002 Inosine-5'-monophosphate dehydrogenase 2 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
OPRM_RAT P33535 CHEMBL270 Mu opioid receptor 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
PDE1B_RAT Q01066 CHEMBL3665 Phosphodiesterase 1B 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
PDE1C_RAT Q63421 CHEMBL2651 Phosphodiesterase 1C 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
PDE5A_HUMAN O76074 CHEMBL1827 Phosphodiesterase 5A 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
PGH1_BOVIN O62664 CHEMBL2860 Cyclooxygenase-1 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
PGH1_HUMAN P23219 CHEMBL221 Cyclooxygenase-1 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
PGH1_SHEEP P05979 CHEMBL2949 Cyclooxygenase-1 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
PGH2_HUMAN P35354 CHEMBL230 Cyclooxygenase-2 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
PGH2_SHEEP P79208 CHEMBL4102 Cyclooxygenase-2 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
Q3I4V7_CRYNV Q3I4V7 CHEMBL1697676 Carbonic anhydrase 2 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
Q4WNT5_ASPFU Q4WNT5 CHEMBL1681623 14-alpha sterol demethylase Cyp51A 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
Q5AJ71_CANAL Q5AJ71 CHEMBL5337 Carbonic anhydrase 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
Q96W81_ASPFM Q96W81 CHEMBL1681624 14-alpha sterol demethylase 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
Q9EPR9_RAT Q9EPR9 CHEMBL2740 Phosphodiesterase 1A 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
SGMR1_HUMAN Q99720 CHEMBL287 Sigma opioid receptor 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
SGMR1_RAT Q9R0C9 CHEMBL3602 Sigma opioid receptor 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
TYSY_HUMAN P04818 CHEMBL1952 Thymidylate synthase 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT1E_HUMAN P28566 CHEMBL2182 Serotonin 1e (5-HT1e) receptor 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT2A_MOUSE P35363 CHEMBL5377 Serotonin 2a (5-HT2a) receptor 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT2B_MOUSE Q02152 CHEMBL2583 Serotonin 2b (5-HT2b) receptor 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT2C_MOUSE P34968 CHEMBL3006 Serotonin 2c (5-HT2c) receptor 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT3B_HUMAN O95264 CHEMBL3895 Serotonin 3b (5-HT3b) receptor 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT3B_MOUSE Q9JHJ5 CHEMBL3781 Serotonin 3b (5-HT3b) receptor 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT3C_HUMAN Q8WXA8 CHEMBL4795 Serotonin 3c (5-HT3c) receptor 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT3D_HUMAN Q70Z44 CHEMBL4673 Serotonin 3d (5-HT3d) receptor 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT3E_HUMAN A5X5Y0 CHEMBL3812 Serotonin 3e (5-HT3e) receptor 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
A0ZX81_KLEPN A0ZX81 CHEMBL1255121 Beta-lactamase 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
A1E3K9_ECOLX A1E3K9 CHEMBL1075073 Beta-lactamase SCO-1 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
A4KCT8_9ENTR A4KCT8 CHEMBL1075063 Gil1 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
A8RR46_BACCS A8RR46 CHEMBL5439 Beta-lactamase 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACE2_RAT Q5EGZ1 CHEMBL2311 Angiotensin-converting enzyme-related carboxypeptidase 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACES_MOUSE P21836 CHEMBL3198 Acetylcholinesterase 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACHA3_HUMAN P32297 CHEMBL3068 Neuronal acetylcholine receptor protein alpha-3 subunit 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACHB2_HUMAN P17787 CHEMBL1883 Neuronal acetylcholine receptor protein beta-2 subunit 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACM2_RAT P10980 CHEMBL309 Muscarinic acetylcholine receptor M2 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACM3_RAT P08483 CHEMBL320 Muscarinic acetylcholine receptor M3 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADRB1_HUMAN P08588 CHEMBL213 Beta-1 adrenergic receptor 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADRB2_CANFA P54833 CHEMBL2289 Beta-2 adrenergic receptor 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADRB3_RAT P26255 CHEMBL4031 Beta-3 adrenergic receptor 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ALBU_BOVIN P02769 CHEMBL3728 Serum albumin 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
AMPC_ECOLI P00811 CHEMBL2026 Beta-lactamase 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
AMPC_PSEAE P24735 CHEMBL5031 Beta-lactamase 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ANDR_MOUSE P19091 CHEMBL3056 Androgen Receptor 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
B0BL08_ECOLX B0BL08 CHEMBL5441 Dihydrofolate reductase 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
B2ZTR6_ACIBA B2ZTR6 CHEMBL1667700 Beta-lactamase ADC-33 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
BLA1_ECOLX P0AD63 CHEMBL5956 Beta-lactamase SHV-1 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
BLA1_KLEPN P0AD64 CHEMBL5094 Beta-lactamase SHV-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
C3SLN2_ECOLX C3SLN2 CHEMBL1287603 DNA gyrase subunit B 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
CA2D1_MOUSE O08532 CHEMBL4676 Voltage-gated calcium channel alpha2/delta subunit 1 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAC1E_RAT Q07652 CHEMBL4115 Voltage-gated R-type calcium channel alpha-1E subunit 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH15_MOUSE Q99N23 CHEMBL5973 Carbonic anhydrase 15 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH1_HUMAN P00915 CHEMBL261 Carbonic anhydrase I 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
CHLE_HUMAN P06276 CHEMBL1914 Butyrylcholinesterase 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
CLAT_RAT P32738 CHEMBL3945 Choline acetylase 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
CNCG_HUMAN Q13956 CHEMBL2341 Phosphodiesterase 6H 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
CNRG_HUMAN P18545 CHEMBL2415 Phosphodiesterase 6G 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
CP51A_HUMAN Q16850 CHEMBL3849 Cytochrome P450 51 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
D6NSM8_ACIBA D6NSM8 CHEMBL1667701 ADC-11 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
DRD1_BOVIN Q95136 CHEMBL2967 Dopamine D1 receptor 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
DRD2_BOVIN P20288 CHEMBL3998 Dopamine D2 receptor 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
DRD2_MOUSE P61168 CHEMBL3427 Dopamine D2 receptor 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
DRD5_HUMAN P21918 CHEMBL1850 Dopamine D5 receptor 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
DRTS_TOXGO Q07422 CHEMBL2425 Dihydrofolate reductase 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
DYR1_ECOLX P00382 CHEMBL2627 Dihydrofolate reductase type 1 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
DYR_BOVIN P00376 CHEMBL1075051 Dihydrofolate reductase 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
DYR_CHICK P00378 CHEMBL2575 Dihydrofolate reductase 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
DYR_ECOLI P0ABQ4 CHEMBL1809 Dihydrofolate reductase 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
DYR_LACCA P00381 CHEMBL2902 Dihydrofolate reductase 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
DYR_PNECA P16184 CHEMBL1926 Dihydrofolate reductase 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
DYR_RAT Q920D2 CHEMBL2363 Dihydrofolate reductase 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
FOLC_HUMAN Q05932 CHEMBL3171 Folylpoly-gamma-glutamate synthetase 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
GASR_RAT P30553 CHEMBL3508 Cholecystokinin B receptor 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
HRH3_HUMAN Q9Y5N1 CHEMBL264 Histamine H3 receptor 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
IL8_HUMAN P10145 CHEMBL2157 Interleukin-8 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
MDR1_HUMAN P08183 CHEMBL4302 P-glycoprotein 1 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
O77823_PIG O77823 CHEMBL3333 Phosphodiesterase 4A 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
P96878_MYCTU P96878 CHEMBL5767 PROBABLE TRANSMEMBRANE CARBONIC ANHYDRASE (CARBONATE DEHYDRATASE) (CARBONIC DEHYDRATASE) 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
PDE11_HUMAN Q9HCR9 CHEMBL2717 Phosphodiesterase 11A 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
PDE1A_HUMAN P54750 CHEMBL3421 Phosphodiesterase 1A 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
PDE1B_HUMAN Q01064 CHEMBL4425 Phosphodiesterase 1B 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
PDE1C_HUMAN Q14123 CHEMBL4619 Phosphodiesterase 1C 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
PDE4A_HUMAN P27815 CHEMBL254 Phosphodiesterase 4A 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
PDE4B_HUMAN Q07343 CHEMBL275 Phosphodiesterase 4B 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
PDE4C_HUMAN Q08493 CHEMBL291 Phosphodiesterase 4C 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
PDE4D_HUMAN Q08499 CHEMBL288 Phosphodiesterase 4D 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
PDE6A_HUMAN P16499 CHEMBL3878 Phosphodiesterase 6A 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
PDE6B_HUMAN P35913 CHEMBL3659 Phosphodiesterase 6B 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
PDE6C_HUMAN P51160 CHEMBL3977 Phosphodiesterase 6C 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
PDE6D_HUMAN O43924 CHEMBL3860 Phosphodiesterase 6D 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
PGH1_RAT Q63921 CHEMBL4042 Cyclooxygenase-1 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
PGH2_BOVIN O62698 CHEMBL3331 Cyclooxygenase-2 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
PGH2_RAT P35355 CHEMBL2977 Cyclooxygenase-2 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
PRGR_RABIT P06186 CHEMBL3456 Progesterone receptor 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
PRGR_RAT Q63449 CHEMBL2596 Progesterone receptor 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
PRIO_HUMAN P04156 CHEMBL4869 Prion protein 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
PTGDS_MOUSE O09114 CHEMBL4334 Prostaglandin-H2 D-isomerase 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
PTR1_LEIMA Q01782 CHEMBL6194 Pteridine reductase 1 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
PYRD_HUMAN Q02127 CHEMBL1966 Dihydroorotate dehydrogenase 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
PYRD_MOUSE O35435 CHEMBL2991 Dihydroorotate dehydrogenase 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
PYRD_RAT Q63707 CHEMBL2383 Dihydroorotate dehydrogenase 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Q2XPY6_SALET Q2XPY6 CHEMBL1667678 Extended-spectrum beta-lactamase CTX-M-53 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Q47245_ECOLX Q47245 CHEMBL1287602 DNA gyrase subunit A 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Q50H31_BRAPL Q50H31 CHEMBL1255145 Class D beta-lactamase 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Q5EM59_BOVIN Q5EM59 CHEMBL3953 Androgen Receptor 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Q6GWS8_ECOLX Q6GWS8 CHEMBL5041 Beta-lactamase TEM-125 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Q81R22_BACAN Q81R22 CHEMBL5270 Dihydrofolate reductase 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Q864F1_PIG Q864F1 CHEMBL3634 Phosphodiesterase 5 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Q9EXV5_ECOLX Q9EXV5 CHEMBL6131 Beta-lactamase 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
RENI_HUMAN P00797 CHEMBL286 Renin 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
RXRA_RAT Q05343 CHEMBL4431 Retinoid X receptor alpha 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
S19A1_HUMAN P41440 CHEMBL4833 Folate transporter 1 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
S22A6_MOUSE Q8VC69 CHEMBL5653 Solute carrier family 22 member 6 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
S22AK_MOUSE Q80UJ1 CHEMBL5269 Solute carrier family 22 member 20 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
SUIS_RAT P23739 CHEMBL3114 Sucrase-isomaltase 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
TYSY_ECOLI P0A884 CHEMBL2555 Thymidylate synthase 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
XDH_BOVIN P80457 CHEMBL3649 Xanthine dehydrogenase 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Y1284_MYCTU P64797 CHEMBL5631 Uncharacterized protein Rv1284/MT1322 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z104288 Z104288 CHEMBL1907594 Neuronal acetylcholine receptor; alpha3/beta4 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z104301 Z104301 CHEMBL1907607 GABA-A receptor; anion channel 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z104303 Z104303 CHEMBL1907609 Muscarinic acetylcholine receptor 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50592 Z50592 CHEMBL374 Oryctolagus cuniculus 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80003 Z80003 CHEMBL614509 1A9/ptx-10 (Ovarian adenocarcinoma cells) 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80004 Z80004 CHEMBL613858 1A9/ptx-22 (Ovarian adenocarcinoma cells) 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT1B_HUMAN P28222 CHEMBL1898 Serotonin 1b (5-HT1b) receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT1D_HUMAN P28221 CHEMBL1983 Serotonin 1d (5-HT1d) receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT1D_PIG P79400 CHEMBL4105 Serotonin 1d (5-HT1d) receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT1F_HUMAN P30939 CHEMBL1805 Serotonin 1f (5-HT1f) receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT2A_BOVIN Q75Z89 CHEMBL3446 Serotonin 2a (5-HT2a) receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT5A_HUMAN P47898 CHEMBL3426 Serotonin 5a (5-HT5a) receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT5A_RAT P35364 CHEMBL4655 Serotonin 5a (5-HT5a) receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT5B_RAT P35365 CHEMBL2619 Serotonin 5b (5-HT5b) receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT6R_RAT P31388 CHEMBL3372 Serotonin 6 (5-HT6) receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
A4ZYU9_ECOLX A4ZYU9 CHEMBL5305 Beta-lactamase ACC-4 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
AA1R_RAT P25099 CHEMBL318 Adenosine A1 receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
AA2AR_RAT P30543 CHEMBL302 Adenosine A2a receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
AAK1_HUMAN Q2M2I8 CHEMBL3830 Adaptor-associated kinase 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ABCC9_RAT Q63563 CHEMBL3244 Sulfonylurea receptor 2 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ABD12_HUMAN Q8N2K0 CHEMBL5516 Monoacylglycerol lipase ABHD12 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ABHGA_HUMAN O95870 CHEMBL6168 Protein BAT5 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ABL1_HUMAN P00519 CHEMBL1862 Tyrosine-protein kinase ABL 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ABL2_HUMAN P42684 CHEMBL4014 Tyrosine-protein kinase ABL2 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACM4_RAT P08485 CHEMBL317 Muscarinic acetylcholine receptor M4 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADA1B_RAT P15823 CHEMBL315 Alpha-1b adrenergic receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADA2A_BOVIN Q28838 CHEMBL4744 Alpha-2a adrenergic receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADA_BOVIN P56658 CHEMBL2966 Adenosine deaminase 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADA_HUMAN P00813 CHEMBL1910 Adenosine deaminase 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADCK3_HUMAN Q8NI60 CHEMBL5550 Chaperone activity of bc1 complex-like, mitochondrial 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADCK4_HUMAN Q96D53 CHEMBL5753 Uncharacterized aarF domain-containing protein kinase 4 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
AK1C3_HUMAN P42330 CHEMBL4681 Aldo-keto-reductase family 1 member C3 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
AL1A7_RAT P13601 CHEMBL5354 Aldehyde dehydrogenase, cytosolic 1 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ALK_HUMAN Q9UM73 CHEMBL4247 ALK tyrosine kinase receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
AMPB_HUMAN Q9H4A4 CHEMBL2432 Aminopeptidase B 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
AMPC_CITFR P05193 CHEMBL1255130 Beta-lactamase 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
AMPC_ENTCL P05364 CHEMBL2725 Beta-lactamase 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
AMPC_MORMO P94958 CHEMBL5764 Beta-lactamase 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
AMPE_HUMAN Q07075 CHEMBL3439 Aminopeptidase A 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
AMPN_HUMAN P15144 CHEMBL1907 Aminopeptidase N 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
AOFB_RAT P19643 CHEMBL2993 Monoamine oxidase B 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
AURKA_HUMAN O14965 CHEMBL4722 Serine/threonine-protein kinase Aurora-A 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
AURKB_HUMAN Q96GD4 CHEMBL2185 Serine/threonine-protein kinase Aurora-B 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
AURKC_HUMAN Q9UQB9 CHEMBL3935 Serine/threonine-protein kinase Aurora-C 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
B5SU02_9CNID B5SU02 CHEMBL1075028 Alpha carbonic anhydrase 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
B8R6A5_9BURK B8R6A5 CHEMBL1641339 PenB class A beta-lactamase 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
BLAC_BACLI P00808 CHEMBL5633 Beta-lactamase 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
BLKPC_KLEPN Q9F663 CHEMBL6132 Carbepenem-hydrolyzing beta-lactamase KPC 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
BLK_HUMAN P51451 CHEMBL2250 Tyrosine-protein kinase BLK 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
BLO1_ECOLX P13661 CHEMBL4951 Beta-lactamase OXA-1 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
BMP2K_HUMAN Q9NSY1 CHEMBL4522 BMP-2-inducible protein kinase 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
C0IX24_9CNID C0IX24 CHEMBL1649055 Carbonic anhydrase 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAC1A_RAT P54282 CHEMBL4417 Voltage-gated P/Q-type calcium channel alpha-1A subunit 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAC1B_RAT Q02294 CHEMBL5107 Voltage-gated N-type calcium channel alpha-1B subunit 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAC1C_HUMAN Q13936 CHEMBL1940 Voltage-gated L-type calcium channel alpha-1C subunit 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAC1C_RABIT P15381 CHEMBL2830 Voltage-gated L-type calcium channel alpha-1C subunit 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAC1D_HUMAN Q01668 CHEMBL4138 Voltage-gated L-type calcium channel alpha-1D subunit 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAC1F_HUMAN O60840 CHEMBL5593 Voltage-gated L-type calcium channel alpha-1F subunit 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAC1G_RAT O54898 CHEMBL4257 Voltage-gated T-type calcium channel alpha-1G subunit 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAC1H_RAT Q9EQ60 CHEMBL5134 Voltage-gated T-type calcium channel alpha-1H subunit 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAC1I_RAT Q9Z0Y8 CHEMBL5459 Voltage-gated T-type calcium channel alpha-1I subunit 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAC1S_HUMAN Q13698 CHEMBL3805 Voltage-gated L-type calcium channel alpha-1S subunit 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAC1S_RAT Q02485 CHEMBL4108 Voltage-gated L-type calcium channel alpha-1S subunit 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH12_HUMAN O43570 CHEMBL3242 Carbonic anhydrase XII 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH13_HUMAN Q8N1Q1 CHEMBL3912 Carbonic anhydrase XIII 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH14_HUMAN Q9ULX7 CHEMBL3510 Carbonic anhydrase XIV 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH4_HUMAN P22748 CHEMBL3729 Carbonic anhydrase IV 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH5A_HUMAN P35218 CHEMBL4789 Carbonic anhydrase VA 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH5B_HUMAN Q9Y2D0 CHEMBL3969 Carbonic anhydrase VB 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH6_HUMAN P23280 CHEMBL3025 Carbonic anhydrase VI 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH7_HUMAN P43166 CHEMBL2326 Carbonic anhydrase VII 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH9_HUMAN Q16790 CHEMBL3594 Carbonic anhydrase IX 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAN_YEAST P53615 CHEMBL5931 Carbonic anhydrase 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CEGT_HUMAN Q16739 CHEMBL2063 Ceramide glucosyltransferase 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CLTR1_HUMAN Q9Y271 CHEMBL1798 Cysteinyl leukotriene receptor 1 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CLTR2_HUMAN Q9NS75 CHEMBL4330 Cysteinyl leukotriene receptor 2 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CNCG_BOVIN P22571 CHEMBL4606 Phosphodiesterase 6H 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CNR1_HUMAN P21554 CHEMBL218 Cannabinoid CB1 receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CNR1_RAT P20272 CHEMBL3571 Cannabinoid CB1 receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CNRG_BOVIN P04972 CHEMBL5111 Phosphodiesterase 6G 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CP3A4_HUMAN P08684 CHEMBL340 Cytochrome P450 3A4 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CSK21_HUMAN P68400 CHEMBL3629 Casein kinase II alpha 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CSK2B_HUMAN P67870 CHEMBL2358 Casein kinase II beta 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CTRO_HUMAN O14578 CHEMBL5579 Citron Rho-interacting kinase 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CXCR1_HUMAN P25024 CHEMBL4029 Interleukin-8 receptor A 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CYNT_HELPY O24855 CHEMBL4211 Carbonic anhydrase 1 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CYNT_MYCTU O53573 CHEMBL6068 Carbonic anhydrase 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
DAPE_HAEIN P44514 CHEMBL1075192 Succinyl-diaminopimelate desuccinylase 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
DDR1_HUMAN Q08345 CHEMBL5319 Epithelial discoidin domain-containing receptor 1 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
DGLA_HUMAN Q9Y4D2 CHEMBL5545 Sn1-specific diacylglycerol lipase alpha 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
DGLB_HUMAN Q8NCG7 CHEMBL5521 Sn1-specific diacylglycerol lipase beta 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
DMPK_HUMAN Q09013 CHEMBL5320 Myotonin-protein kinase 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
DRD1_MOUSE Q61616 CHEMBL3071 Dopamine D1 receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
DRD1_PIG P50130 CHEMBL5067 Dopamine D1 receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
DRD2_CHLAE P52702 CHEMBL5456 Dopamine D2 receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
E1BN64_BOVIN E1BN64 CHEMBL5129 Phosphodiesterase 3B 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
E2AK2_HUMAN P19525 CHEMBL5785 Interferon-induced, double-stranded RNA-activated protein kinase 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
E2AK4_HUMAN Q9P2K8 CHEMBL5358 Eukaryotic translation initiation factor 2-alpha kinase 4 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
EBP_HUMAN Q15125 CHEMBL4931 3-beta-hydroxysteroid-delta(8),delta(7)-isomerase 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
EGFR_HUMAN P00533 CHEMBL203 Epidermal growth factor receptor erbB1 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
EPHA3_HUMAN P29320 CHEMBL4954 Ephrin type-A receptor 3 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
EPHA6_HUMAN Q9UF33 CHEMBL4526 Ephrin type-A receptor 6 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
EPHA7_HUMAN Q15375 CHEMBL4602 Ephrin type-A receptor 7 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
EPHA8_HUMAN P29322 CHEMBL4134 Ephrin type-A receptor 8 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ERBB2_HUMAN P04626 CHEMBL1824 Receptor protein-tyrosine kinase erbB-2 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ERBB4_HUMAN Q15303 CHEMBL3009 Receptor protein-tyrosine kinase erbB-4 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ERG2_YEAST P32352 CHEMBL3224 C-8 sterol isomerase 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ESR1_HUMAN P03372 CHEMBL206 Estrogen receptor alpha 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ESR2_HUMAN Q92731 CHEMBL242 Estrogen receptor beta 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
FABPL_RAT P02692 CHEMBL5738 Fatty acid-binding protein, liver 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
FDFT_HUMAN P37268 CHEMBL3338 Squalene synthetase 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
FGFR2_HUMAN P21802 CHEMBL4142 Fibroblast growth factor receptor 2 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
FGR_HUMAN P09769 CHEMBL4454 Tyrosine-protein kinase FGR 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
FLT3_HUMAN P36888 CHEMBL1974 Tyrosine-protein kinase receptor FLT3 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
FRK_HUMAN P42685 CHEMBL4223 Tyrosine-protein kinase FRK 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
FUCO_BOVIN Q2KIM0 CHEMBL3545 Alpha-L-fucosidase 1 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
FUCO_HUMAN P04066 CHEMBL4176 Alpha-L-fucosidase I 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
GAK_HUMAN O14976 CHEMBL4355 Serine/threonine-protein kinase GAK 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
GBRA1_HUMAN P14867 CHEMBL1962 GABA receptor alpha-1 subunit 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
GBRA1_RAT P62813 CHEMBL343 GABA receptor alpha-1 subunit 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
GBRA2_HUMAN P47869 CHEMBL4956 GABA receptor alpha-2 subunit 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
GBRA2_RAT P23576 CHEMBL341 GABA receptor alpha-2 subunit 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
GBRA3_HUMAN P34903 CHEMBL3026 GABA receptor alpha-3 subunit 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
GBRA3_RAT P20236 CHEMBL328 GABA receptor alpha-3 subunit 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
GBRA4_RAT P28471 CHEMBL292 GABA receptor alpha-4 subunit 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
GBRA5_RAT P19969 CHEMBL300 GABA receptor alpha-5 subunit 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
GBRA6_RAT P30191 CHEMBL293 GABA receptor alpha-6 subunit 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
GBRB2_HUMAN P47870 CHEMBL1920 GABA receptor beta-2 subunit 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
GBRB2_RAT P63138 CHEMBL295 GABA receptor beta-2 subunit 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
GBRB3_HUMAN P28472 CHEMBL1847 GABA receptor beta-3 subunit 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
GBRB3_RAT P63079 CHEMBL316 GABA receptor beta-3 subunit 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
GBRG2_HUMAN P18507 CHEMBL1788 GABA receptor gamma-2 subunit 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
GBRG2_RAT P18508 CHEMBL297 GABA receptor gamma-2 subunit 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
GBRG3_RAT P28473 CHEMBL336 GABA receptor gamma-3 subunit 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
GCR_HUMAN P04150 CHEMBL2034 Glucocorticoid receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
GYRA_ECOLI P0AES4 CHEMBL1858 DNA gyrase subunit A 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
GYRB_ECOLI P0AES6 CHEMBL1826 DNA gyrase subunit B 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
HCK_HUMAN P08631 CHEMBL3234 Tyrosine-protein kinase HCK 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
HIF1A_HUMAN Q16665 CHEMBL4261 Hypoxia-inducible factor 1 alpha 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
HMDH_MOUSE Q01237 CHEMBL2764 HMG-CoA reductase 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
HRH2_RAT P25102 CHEMBL4654 Histamine H2 receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
HRH3_RAT Q9QYN8 CHEMBL4124 Histamine H3 receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
HRH4_HUMAN Q9H3N8 CHEMBL3759 Histamine H4 receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
HRH4_RAT Q91ZY1 CHEMBL4468 Histamine H4 receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
IRK11_RAT P70673 CHEMBL3704 Potassium channel, inwardly rectifying, subfamily J, member 11 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
IRK8_RAT Q63664 CHEMBL4293 Potassium channel, inwardly rectifying, subfamily J, member 8 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
JAK3_HUMAN P52333 CHEMBL2148 Tyrosine-protein kinase JAK3 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
KC1D_HUMAN P48730 CHEMBL2828 Casein kinase I delta 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
KCNA5_HUMAN P22460 CHEMBL4306 Voltage-gated potassium channel subunit Kv1.5 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
KCND3_HUMAN Q9UK17 CHEMBL1964 Voltage-gated potassium channel subunit Kv4.3 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
KIT_HUMAN P10721 CHEMBL1936 Stem cell growth factor receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
KS6A4_HUMAN O75676 CHEMBL3125 Ribosomal protein S6 kinase alpha 4 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
LACB_BOVIN P02754 CHEMBL1075053 Beta-lactoglobulin 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
LCK_HUMAN P06239 CHEMBL258 Tyrosine-protein kinase LCK 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
LEF_BACAN P15917 CHEMBL4372 Anthrax lethal factor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
LIPP_PIG P00591 CHEMBL1687677 Pancreatic triacylglycerol lipase 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
LKHA4_HUMAN P09960 CHEMBL4618 Leukotriene A4 hydrolase 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
LTK_HUMAN P29376 CHEMBL5627 Leukocyte tyrosine kinase receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
LYAG_HUMAN P10253 CHEMBL2608 Lysosomal alpha-glucosidase 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
LYAG_RAT Q6P7A9 CHEMBL3513 Acidic alpha-glucosidase 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
LYN_HUMAN P07948 CHEMBL3905 Tyrosine-protein kinase Lyn 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
MCR_HUMAN P08235 CHEMBL1994 Mineralocorticoid receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
MET_HUMAN P08581 CHEMBL3717 Hepatocyte growth factor receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
MK04_HUMAN P31152 CHEMBL5759 Mitogen-activated protein kinase 4 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
MK09_HUMAN P45984 CHEMBL4179 c-Jun N-terminal kinase 2 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
MKNK1_HUMAN Q9BUB5 CHEMBL4718 MAP kinase-interacting serine/threonine-protein kinase MNK1 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
MKNK2_HUMAN Q9HBH9 CHEMBL4204 MAP kinase signal-integrating kinase 2 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
MRCKG_HUMAN Q6DT37 CHEMBL5615 Serine/threonine-protein kinase MRCK gamma 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
MURA_ECOLI P0A749 CHEMBL1984 UDP-N-acetylglucosamine 1-carboxyvinyltransferase 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
MYLK2_HUMAN Q9H1R3 CHEMBL2777 myosin light chain kinase 2 1 Annotations