UCSF

Sphinx Make-on-demand

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

Binding 1μM Targets with Highest Number of Available Compounds (276 in total)

Name (Uniprot) Swissprot ChEMBL Description Size Browse Download (Annotations)
AKT2_HUMAN P31751 CHEMBL2431 Serine/threonine-protein kinase AKT2 42 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT1A_RAT P19327 CHEMBL273 Serotonin 1a (5-HT1a) receptor 16 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT1B_RAT P28564 CHEMBL3459 Serotonin 1b (5-HT1b) receptor 13 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT1D_RAT P28565 CHEMBL5450 Serotonin 1d (5-HT1d) receptor 13 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT1F_RAT P30940 CHEMBL4646 Serotonin 1f (5-HT1f) receptor 13 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z104304 Z104304 CHEMBL1907610 Adrenergic receptor alpha-1 13 Annotations Catalogs SMILES SDF Mol2 Flexibase
GSK3B_HUMAN P49841 CHEMBL262 Glycogen synthase kinase-3 beta 11 Annotations Catalogs SMILES SDF Mol2 Flexibase
NOS2_HUMAN P35228 CHEMBL4481 Nitric oxide synthase, inducible 11 Annotations Catalogs SMILES SDF Mol2 Flexibase
C11B1_HUMAN P15538 CHEMBL1908 Cytochrome P450 11B1 10 Annotations Catalogs SMILES SDF Mol2 Flexibase
C11B2_HUMAN P19099 CHEMBL2722 Cytochrome P450 11B2 9 Annotations Catalogs SMILES SDF Mol2 Flexibase
NOS1_HUMAN P29475 CHEMBL3568 Nitric-oxide synthase, brain 9 Annotations Catalogs SMILES SDF Mol2 Flexibase
MTR1B_HUMAN P49286 CHEMBL1946 Melatonin receptor 1B 8 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT2A_RAT P14842 CHEMBL322 Serotonin 2a (5-HT2a) receptor 7 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT2B_RAT P30994 CHEMBL323 Serotonin 2b (5-HT2b) receptor 7 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT2C_RAT P08909 CHEMBL324 Serotonin 2c (5-HT2c) receptor 7 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADA2A_BOVIN Q28838 CHEMBL4744 Alpha-2a adrenergic receptor 7 Annotations Catalogs SMILES SDF Mol2 Flexibase
FLT3_HUMAN P36888 CHEMBL1974 Tyrosine-protein kinase receptor FLT3 7 Annotations Catalogs SMILES SDF Mol2 Flexibase
MTR1A_HUMAN P48039 CHEMBL1945 Melatonin receptor 1A 7 Annotations Catalogs SMILES SDF Mol2 Flexibase
NOS3_HUMAN P29474 CHEMBL4803 Nitric-oxide synthase, endothelial 7 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADRB1_RAT P18090 CHEMBL3252 Beta-1 adrenergic receptor 6 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADRB3_RAT P26255 CHEMBL4031 Beta-3 adrenergic receptor 6 Annotations Catalogs SMILES SDF Mol2 Flexibase
DRD2_RAT P61169 CHEMBL339 Dopamine D2 receptor 6 Annotations Catalogs SMILES SDF Mol2 Flexibase
NQO2_HUMAN P16083 CHEMBL3959 Quinone reductase 2 6 Annotations Catalogs SMILES SDF Mol2 Flexibase
PARP1_HUMAN P09874 CHEMBL3105 Poly [ADP-ribose] polymerase-1 6 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACH10_RAT Q9JLB5 CHEMBL3461 Neuronal acetylcholine receptor protein alpha-10 subunit 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACHA3_RAT P04757 CHEMBL3818 Neuronal acetylcholine receptor protein alpha-3 subunit 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACHA4_RAT P09483 CHEMBL307 Neuronal acetylcholine receptor protein alpha-4 subunit 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADA1A_HUMAN P35348 CHEMBL229 Alpha-1a adrenergic receptor 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADA1B_HUMAN P35368 CHEMBL232 Alpha-1b adrenergic receptor 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADA1D_HUMAN P25100 CHEMBL223 Alpha-1d adrenergic receptor 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
AKT1_HUMAN P31749 CHEMBL4282 Serine/threonine-protein kinase AKT 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
DRD4_HUMAN P21917 CHEMBL219 Dopamine D4 receptor 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
KIT_HUMAN P10721 CHEMBL1936 Stem cell growth factor receptor 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
VGFR2_HUMAN P35968 CHEMBL279 Vascular endothelial growth factor receptor 2 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT1E_HUMAN P28566 CHEMBL2182 Serotonin 1e (5-HT1e) receptor 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
A3EZI9_9HEPC A3EZI9 CHEMBL4893 Hepatitis C virus NS3 protease/helicase 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACHA7_HUMAN P36544 CHEMBL2492 Neuronal acetylcholine receptor protein alpha-7 subunit 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADRB2_CANFA P54833 CHEMBL2289 Beta-2 adrenergic receptor 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
CATS_HUMAN P25774 CHEMBL2954 Cathepsin S 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
HRH1_HUMAN P35367 CHEMBL231 Histamine H1 receptor 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
NOS1_RAT P29476 CHEMBL3048 Nitric-oxide synthase, brain 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z104283 Z104283 CHEMBL1907589 Neuronal acetylcholine receptor; alpha4/beta2 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z104290 Z104290 CHEMBL1907596 Neuronal acetylcholine receptor; alpha4/beta2 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT1A_HUMAN P08908 CHEMBL214 Serotonin 1a (5-HT1a) receptor 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT1D_HUMAN P28221 CHEMBL1983 Serotonin 1d (5-HT1d) receptor 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT3A_HUMAN P46098 CHEMBL1899 Serotonin 3a (5-HT3a) receptor 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT3B_HUMAN O95264 CHEMBL3895 Serotonin 3b (5-HT3b) receptor 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT3C_HUMAN Q8WXA8 CHEMBL4795 Serotonin 3c (5-HT3c) receptor 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT3D_HUMAN Q70Z44 CHEMBL4673 Serotonin 3d (5-HT3d) receptor 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT3E_HUMAN A5X5Y0 CHEMBL3812 Serotonin 3e (5-HT3e) receptor 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADA2A_RAT P22909 CHEMBL327 Alpha-2a adrenergic receptor 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADA2B_RAT P19328 CHEMBL266 Alpha-2b adrenergic receptor 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADA2C_RAT P22086 CHEMBL314 Alpha-2c adrenergic receptor 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
HCAR2_RAT Q80Z39 CHEMBL4731 HM74 nicotinic acid GPCR 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
HRH4_HUMAN Q9H3N8 CHEMBL3759 Histamine H4 receptor 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
OXDA_HUMAN P14920 CHEMBL5485 D-amino-acid oxidase 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
SGMR1_RAT Q9R0C9 CHEMBL3602 Sigma opioid receptor 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z104301 Z104301 CHEMBL1907607 GABA-A receptor; anion channel 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT1B_HUMAN P28222 CHEMBL1898 Serotonin 1b (5-HT1b) receptor 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT2C_HUMAN P28335 CHEMBL225 Serotonin 2c (5-HT2c) receptor 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
AA3R_HUMAN P33765 CHEMBL256 Adenosine A3 receptor 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACHA2_RAT P12389 CHEMBL2584 Neuronal acetylcholine receptor protein alpha-2 subunit 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
ACHA4_MOUSE O70174 CHEMBL4457 Neuronal acetylcholine receptor protein alpha-4 subunit 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACHA5_RAT P20420 CHEMBL4960 Neuronal acetylcholine receptor protein alpha-5 subunit 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACHA6_RAT P43143 CHEMBL4747 Neuronal acetylcholine receptor protein alpha-6 subunit 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACHA7_RAT Q05941 CHEMBL4980 Neuronal acetylcholine receptor protein alpha-7 subunit 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACHA9_RAT P43144 CHEMBL2585 Neuronal acetylcholine receptor protein alpha-9 subunit 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACHA_RAT P25108 CHEMBL3599 Acetylcholine receptor protein alpha chain 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACHA_TORCA P02710 CHEMBL3097 Acetylcholine receptor protein alpha chain 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
ACHB2_RAT P12390 CHEMBL3001 Neuronal acetylcholine receptor protein beta-2 subunit 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACHB3_RAT P12391 CHEMBL4568 Neuronal acetylcholine receptor protein beta-3 subunit 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACHB4_RAT P12392 CHEMBL2658 Neuronal acetylcholine receptor protein beta-4 subunit 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACHB_RAT P25109 CHEMBL2666 Acetylcholine receptor protein beta chain 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACHB_TORCA P02712 CHEMBL3803 Acetylcholine receptor protein beta chain 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACHD_TORCA P02718 CHEMBL3916 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
ADA2A_HUMAN P08913 CHEMBL1867 Alpha-2a adrenergic receptor 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADA2B_HUMAN P18089 CHEMBL1942 Alpha-2b adrenergic receptor 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADA2C_HUMAN P18825 CHEMBL1916 Alpha-2c adrenergic receptor 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADRB1_HUMAN P08588 CHEMBL213 Beta-1 adrenergic receptor 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADRB2_HUMAN P07550 CHEMBL210 Beta-2 adrenergic receptor 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ATP4A_HUMAN P20648 CHEMBL1802 Potassium-transporting ATPase alpha chain 1 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ATP4B_HUMAN P51164 CHEMBL5207 Potassium-transporting ATPase beta chain 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
CP19A_HUMAN P11511 CHEMBL1978 Cytochrome P450 19A1 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
DRD2_HUMAN P14416 CHEMBL217 Dopamine D2 receptor 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
GSK3A_HUMAN P49840 CHEMBL2850 Glycogen synthase kinase-3 alpha 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
HCAR2_HUMAN Q8TDS4 CHEMBL3785 Nicotinic acid receptor 1 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
HRH3_HUMAN Q9Y5N1 CHEMBL264 Histamine H3 receptor 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
KCNH2_HUMAN Q12809 CHEMBL240 HERG 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
OPRK_HUMAN P41145 CHEMBL237 Kappa opioid receptor 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
PCP_HUMAN P42785 CHEMBL2335 Lysosomal Pro-X carboxypeptidase 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
PGH1_HUMAN P23219 CHEMBL221 Cyclooxygenase-1 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
PGH1_RAT Q63921 CHEMBL4042 Cyclooxygenase-1 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
PGH1_SHEEP P05979 CHEMBL2949 Cyclooxygenase-1 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
PGH2_HUMAN P35354 CHEMBL230 Cyclooxygenase-2 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
PGH2_MOUSE Q05769 CHEMBL4321 Cyclooxygenase-2 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Q8BGP7_MOUSE Q8BGP7 CHEMBL2235 Neuronal acetylcholine receptor protein beta-2 subunit 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
SC6A2_HUMAN P23975 CHEMBL222 Norepinephrine transporter 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
SC6A3_HUMAN Q01959 CHEMBL238 Dopamine transporter 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
XDH_BOVIN P80457 CHEMBL3649 Xanthine dehydrogenase 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50587 Z50587 CHEMBL372 Homo sapiens 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT1A_MOUSE Q64264 CHEMBL3737 Serotonin 1a (5-HT1a) receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT2A_HUMAN P28223 CHEMBL224 Serotonin 2a (5-HT2a) receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT2A_MOUSE P35363 CHEMBL5377 Serotonin 2a (5-HT2a) receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT2B_HUMAN P41595 CHEMBL1833 Serotonin 2b (5-HT2b) receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT2B_MOUSE Q02152 CHEMBL2583 Serotonin 2b (5-HT2b) receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT2C_MOUSE P34968 CHEMBL3006 Serotonin 2c (5-HT2c) receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT5A_MOUSE P30966 CHEMBL3597 Serotonin 5a (5-HT5a) receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT6R_HUMAN P50406 CHEMBL3371 Serotonin 6 (5-HT6) receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT7R_HUMAN P34969 CHEMBL3155 Serotonin 7 (5-HT7) receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
AA1R_RAT P25099 CHEMBL318 Adenosine A1 receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACE_HUMAN P12821 CHEMBL1808 Angiotensin-converting enzyme 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACM1_HUMAN P11229 CHEMBL216 Muscarinic acetylcholine receptor M1 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACM1_MOUSE P12657 CHEMBL3733 Muscarinic acetylcholine receptor M1 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACM1_RAT P08482 CHEMBL276 Muscarinic acetylcholine receptor M1 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACM2_HUMAN P08172 CHEMBL211 Muscarinic acetylcholine receptor M2 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACM2_RAT P10980 CHEMBL309 Muscarinic acetylcholine receptor M2 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACM3_HUMAN P20309 CHEMBL245 Muscarinic acetylcholine receptor M3 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACM3_RAT P08483 CHEMBL320 Muscarinic acetylcholine receptor M3 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACM4_HUMAN P08173 CHEMBL1821 Muscarinic acetylcholine receptor M4 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACM4_RAT P08485 CHEMBL317 Muscarinic acetylcholine receptor M4 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACM5_HUMAN P08912 CHEMBL2035 Muscarinic acetylcholine receptor M5 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADA1A_BOVIN P18130 CHEMBL4892 Alpha-1a adrenergic receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADA1A_RAT P43140 CHEMBL319 Alpha-1a adrenergic receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADA2B_BOVIN O77700 CHEMBL3523 Alpha-2b adrenergic receptor 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
B1WBY8_RAT B1WBY8 CHEMBL4705 Histone deacetylase 2 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CARM1_HUMAN Q86X55 CHEMBL5406 Histone-arginine methyltransferase CARM1 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CATK_HUMAN P43235 CHEMBL268 Cathepsin K 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CBR1_HUMAN P16152 CHEMBL5586 Carbonyl reductase [NADPH] 1 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CDK19_HUMAN Q9BWU1 CHEMBL6002 Cell division cycle 2-like protein kinase 6 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CDK8_HUMAN P49336 CHEMBL5719 Cell division protein kinase 8 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CSF1R_HUMAN P07333 CHEMBL1844 Macrophage colony stimulating factor receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CTRA_BOVIN P00766 CHEMBL3314 Alpha-chymotrypsin 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
DDR1_HUMAN Q08345 CHEMBL5319 Epithelial discoidin domain-containing receptor 1 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
DPP4_HUMAN P27487 CHEMBL284 Dipeptidyl peptidase IV 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
DRD1_RAT P18901 CHEMBL265 Dopamine D1 receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
DRD2_MOUSE P61168 CHEMBL3427 Dopamine D2 receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
DRD3_HUMAN P35462 CHEMBL234 Dopamine D3 receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
DRD3_RAT P19020 CHEMBL3138 Dopamine D3 receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
DRD4_RAT P30729 CHEMBL3361 Dopamine D4 receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
DRD5_RAT P25115 CHEMBL2281 Dopamine D5 receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
DYR1A_HUMAN Q13627 CHEMBL2292 Dual-specificity tyrosine-phosphorylation regulated kinase 1A 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
DYR_HUMAN P00374 CHEMBL202 Dihydrofolate reductase 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
DYR_MYCTU P0A546 CHEMBL6065 Dihydrofolate reductase 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
EGFR_HUMAN P00533 CHEMBL203 Epidermal growth factor receptor erbB1 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
EPHA6_HUMAN Q9UF33 CHEMBL4526 Ephrin type-A receptor 6 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ERG1_HUMAN Q14534 CHEMBL3592 Squalene monooxygenase 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
EST1_HUMAN P23141 CHEMBL2265 Acyl coenzyme A:cholesterol acyltransferase 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
FABI_BACSU P54616 CHEMBL1075044 Enoyl-[acyl-carrier-protein] reductase [NADH] 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
FABI_ECOLI P0AEK4 CHEMBL1857 Enoyl-[acyl-carrier-protein] reductase 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
FABI_STAAR Q6GI75 CHEMBL3994 Enoyl-[acyl-carrier-protein] reductase 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
FABPI_HUMAN P12104 CHEMBL4879 Fatty acid binding protein intestinal 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
FABPL_RAT P02692 CHEMBL5738 Fatty acid-binding protein, liver 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
FRK_HUMAN P42685 CHEMBL4223 Tyrosine-protein kinase FRK 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
FYN_HUMAN P06241 CHEMBL1841 Tyrosine-protein kinase FYN 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
GRM5_RAT P31424 CHEMBL2564 Metabotropic glutamate receptor 5 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
HDA10_HUMAN Q969S8 CHEMBL5103 Histone deacetylase 10 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
HDA11_HUMAN Q96DB2 CHEMBL3310 Histone deacetylase 11 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
HDAC1_HUMAN Q13547 CHEMBL325 Histone deacetylase 1 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
HDAC1_MOUSE O09106 CHEMBL4001 Histone deacetylase 1 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
HDAC1_RAT Q4QQW4 CHEMBL2915 Histone deacetylase 1 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
HDAC2_HUMAN Q92769 CHEMBL1937 Histone deacetylase 2 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
HDAC3_HUMAN O15379 CHEMBL1829 Histone deacetylase 3 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
HDAC3_RAT Q6P6W3 CHEMBL2628 Histone deacetylase 3 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
HDAC4_HUMAN P56524 CHEMBL3524 Histone deacetylase 4 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
HDAC4_RAT Q99P99 CHEMBL2874 Histone deacetylase 4 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
HDAC5_HUMAN Q9UQL6 CHEMBL2563 Histone deacetylase 5 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
HDAC6_HUMAN Q9UBN7 CHEMBL1865 Histone deacetylase 6 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
HDAC7_HUMAN Q8WUI4 CHEMBL2716 Histone deacetylase 7 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
HDAC7_RAT Q99P96 CHEMBL2914 Histone deacetylase 7 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
HDAC8_HUMAN Q9BY41 CHEMBL3192 Histone deacetylase 8 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
HDAC9_HUMAN Q9UKV0 CHEMBL4145 Histone deacetylase 9 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
HDAH_ALCSD Q70I53 CHEMBL6017 Histone deacetylase-like amidohydrolase 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
HRH2_HUMAN P25021 CHEMBL1941 Histamine H2 receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
HRH3_MOUSE P58406 CHEMBL3263 Histamine H3 receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
HRH3_RAT Q9QYN8 CHEMBL4124 Histamine H3 receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
HRH4_MOUSE Q91ZY2 CHEMBL5657 Histamine H4 receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
HRH4_RAT Q91ZY1 CHEMBL4468 Histamine H4 receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
HS90A_HUMAN P07900 CHEMBL3880 Heat shock protein HSP 90-alpha 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
I23O1_HUMAN P14902 CHEMBL4685 Indoleamine 2,3-dioxygenase 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
IGF1R_HUMAN P08069 CHEMBL1957 Insulin-like growth factor I receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
INHA_MYCTU P0A5Y6 CHEMBL1849 Enoyl-[acyl-carrier-protein] reductase 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
JAK3_HUMAN P52333 CHEMBL2148 Tyrosine-protein kinase JAK3 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
KPCA_HUMAN P17252 CHEMBL299 Protein kinase C alpha 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
KPCB_HUMAN P05771 CHEMBL3045 Protein kinase C beta 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
KPCD1_HUMAN Q15139 CHEMBL3863 Protein kinase C mu 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
KPCD3_HUMAN O94806 CHEMBL2595 Protein kinase C nu 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
KPCD_HUMAN Q05655 CHEMBL2996 Protein kinase C delta 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
KPCE_HUMAN Q02156 CHEMBL3582 Protein kinase C epsilon 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
KPCG_HUMAN P05129 CHEMBL2938 Protein kinase C gamma 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
KPCI_HUMAN P41743 CHEMBL2598 Protein kinase C iota 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
KPCL_HUMAN P24723 CHEMBL3616 Protein kinase C eta 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
KPCT_HUMAN Q04759 CHEMBL3920 Protein kinase C theta 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
KPCZ_HUMAN Q05513 CHEMBL3438 Protein kinase C zeta 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
KS6B1_HUMAN P23443 CHEMBL4501 Ribosomal protein S6 kinase 1 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
LCK_HUMAN P06239 CHEMBL258 Tyrosine-protein kinase LCK 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
LOX5_RAT P12527 CHEMBL312 Arachidonate 5-lipoxygenase 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
LTK_HUMAN P29376 CHEMBL5627 Leukocyte tyrosine kinase receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
M4K1_HUMAN Q92918 CHEMBL5749 Mitogen-activated protein kinase kinase kinase kinase 1 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
M4K5_HUMAN Q9Y4K4 CHEMBL4852 Mitogen-activated protein kinase kinase kinase kinase 5 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
MERTK_HUMAN Q12866 CHEMBL5331 Proto-oncogene tyrosine-protein kinase MER 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
MK09_HUMAN P45984 CHEMBL4179 c-Jun N-terminal kinase 2 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
MKNK2_HUMAN Q9HBH9 CHEMBL4204 MAP kinase signal-integrating kinase 2 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
MT3_HUMAN P25713 CHEMBL1250357 Metallothionein-3 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
MUSK_HUMAN O15146 CHEMBL5684 Muscle, skeletal receptor tyrosine protein kinase 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
NCOR2_HUMAN Q9Y618 CHEMBL5949 Nuclear receptor corepressor 2 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
NISCH_HUMAN Q9Y2I1 CHEMBL3923 Nischarin 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
NISCH_RAT Q4G017 CHEMBL5221 Nischarin 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
NOS2_MOUSE P29477 CHEMBL3464 Nitric oxide synthase, inducible 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
NOS3_BOVIN P29473 CHEMBL4802 Nitric-oxide synthase, endothelial 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
NTRK1_HUMAN P04629 CHEMBL2815 Nerve growth factor receptor Trk-A 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
NTRK3_HUMAN Q16288 CHEMBL5608 NT-3 growth factor receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
OPRM_HUMAN P35372 CHEMBL233 Mu opioid receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
OXDA_PIG P00371 CHEMBL6172 D-amino-acid oxidase 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
PDE10_HUMAN Q9Y233 CHEMBL4409 Phosphodiesterase 10A 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
PDE10_RAT Q9QYJ6 CHEMBL6140 cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
PDE3A_HUMAN Q14432 CHEMBL241 Phosphodiesterase 3A 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
PDE3B_HUMAN Q13370 CHEMBL290 Phosphodiesterase 3B 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
PDE4A_HUMAN P27815 CHEMBL254 Phosphodiesterase 4A 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
PDE4A_RAT P54748 CHEMBL4964 Phosphodiesterase 4A 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
PDE4B_HUMAN Q07343 CHEMBL275 Phosphodiesterase 4B 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
PDE4B_RAT P14646 CHEMBL3382 Phosphodiesterase 4B 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
PDE4C_HUMAN Q08493 CHEMBL291 Phosphodiesterase 4C 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
PDE4C_RAT P14644 CHEMBL4562 Phosphodiesterase 4C 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
PDE4D_HUMAN Q08499 CHEMBL288 Phosphodiesterase 4D 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
PDE4D_RAT P14270 CHEMBL2712 Phosphodiesterase 4D 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
PDE5A_HUMAN O76074 CHEMBL1827 Phosphodiesterase 5A 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
PERM_HUMAN P05164 CHEMBL2439 Myeloperoxidase 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
PGFRA_HUMAN P16234 CHEMBL2007 Platelet-derived growth factor receptor alpha 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
PGFRB_HUMAN P09619 CHEMBL1913 Platelet-derived growth factor receptor beta 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
PNMT_BOVIN P10938 CHEMBL2331 Phenylethanolamine N-methyltransferase 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Q5RJZ2_RAT Q5RJZ2 CHEMBL4025 Histone deacetylase 5 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Q6UCJ9_TOXGO Q6UCJ9 CHEMBL1250368 Enoyl-acyl carrier reductase 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Q72874_9HIV1 Q72874 CHEMBL243 Human immunodeficiency virus type 1 protease 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Q7K6A1_PLAF7 Q7K6A1 CHEMBL1293190 Histone deacetylase 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Q94F81_MAIZE Q94F81 CHEMBL4919 Histone deacetylase HD2 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Q965D5_PLAFA Q965D5 CHEMBL4150 Enoyl-acyl-carrier protein reductase 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Q99P97_RAT Q99P97 CHEMBL3101 Histone deacetylase 6 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Q9BJJ9_PLAFA Q9BJJ9 CHEMBL1275211 Enoyl-ACP reductase 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Q9XSW7_PIG Q9XSW7 CHEMBL3061 Phosphodiesterase 3A 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Q9XYC7_PLAFA Q9XYC7 CHEMBL5541 Histone deacetylase 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Q9ZTP8_MAIZE Q9ZTP8 CHEMBL3541 Histone deacetylase HD1B 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
RAF1_HUMAN P04049 CHEMBL1906 Serine/threonine-protein kinase RAF 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
RARB_HUMAN P10826 CHEMBL2008 Retinoic acid receptor beta 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
RARG_HUMAN P13631 CHEMBL2003 Retinoic acid receptor gamma 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
RET_HUMAN P07949 CHEMBL2041 Tyrosine-protein kinase receptor RET 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
SC6A4_RAT P31652 CHEMBL313 Serotonin transporter 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
SCN1A_HUMAN P35498 CHEMBL1845 Sodium channel protein type I alpha subunit 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
SCN2A_HUMAN Q99250 CHEMBL4187 Sodium channel protein type II alpha subunit 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
SCN3A_HUMAN Q9NY46 CHEMBL5163 Sodium channel protein type III alpha subunit 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
SCN8A_HUMAN Q9UQD0 CHEMBL5202 Sodium channel protein type VIII alpha subunit 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
SGMR1_HUMAN Q99720 CHEMBL287 Sigma opioid receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
SLK_HUMAN Q9H2G2 CHEMBL4202 Serine/threonine-protein kinase 2 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ST32B_HUMAN Q9NY57 CHEMBL5912 Serine/threonine-protein kinase 32B 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
STK10_HUMAN O94804 CHEMBL3981 Serine/threonine-protein kinase 10 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
SUIS_RAT P23739 CHEMBL3114 Sucrase-isomaltase 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
THRB_HUMAN P00734 CHEMBL204 Thrombin 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
TIE1_HUMAN P35590 CHEMBL5274 Tyrosine-protein kinase receptor Tie-1 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
TIE2_HUMAN Q02763 CHEMBL4128 Tyrosine-protein kinase TIE-2 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
TRY1_BOVIN P00760 CHEMBL3769 Trypsin I 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
TRY1_HUMAN P07477 CHEMBL209 Trypsin I 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
UFO_HUMAN P30530 CHEMBL4895 Tyrosine-protein kinase receptor UFO 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
VGFR1_HUMAN P17948 CHEMBL1868 Vascular endothelial growth factor receptor 1 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
VGFR3_HUMAN P35916 CHEMBL1955 Vascular endothelial growth factor receptor 3 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
XDH_HUMAN P47989 CHEMBL1929 Xanthine dehydrogenase 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
XDH_RAT P22985 CHEMBL1075246 Xanthine dehydrogenase/oxidase 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z104281 Z104281 CHEMBL1907587 Neuronal acetylcholine receptor; alpha3/beta2 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z104303 Z104303 CHEMBL1907609 Muscarinic acetylcholine receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase