UCSF

HMDB Drug Metabolites

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

Binding 1μM Targets with Highest Number of Available Compounds (241 in total)

Name (Uniprot) Swissprot ChEMBL Description Size Browse Download (Annotations)
ADA1A_RAT P43140 CHEMBL319 Alpha-1a adrenergic receptor 8 Annotations Catalogs SMILES SDF Mol2 Flexibase
OPRM_HUMAN P35372 CHEMBL233 Mu opioid receptor 7 Annotations Catalogs SMILES SDF Mol2 Flexibase
DRD2_HUMAN P14416 CHEMBL217 Dopamine D2 receptor 6 Annotations Catalogs SMILES SDF Mol2 Flexibase
OPRK_HUMAN P41145 CHEMBL237 Kappa opioid receptor 6 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT2A_HUMAN P28223 CHEMBL224 Serotonin 2a (5-HT2a) receptor 5 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
HRH1_HUMAN P35367 CHEMBL231 Histamine H1 receptor 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
OPRD_HUMAN P41143 CHEMBL236 Delta opioid receptor 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
SC6A3_RAT P23977 CHEMBL338 Dopamine transporter 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
SC6A4_HUMAN P31645 CHEMBL228 Serotonin transporter 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT1A_RAT P19327 CHEMBL273 Serotonin 1a (5-HT1a) receptor 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT2A_RAT P14842 CHEMBL322 Serotonin 2a (5-HT2a) receptor 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT2C_HUMAN P28335 CHEMBL225 Serotonin 2c (5-HT2c) receptor 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
ESR1_HUMAN P03372 CHEMBL206 Estrogen receptor alpha 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
ESR2_HUMAN Q92731 CHEMBL242 Estrogen receptor beta 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
OPRD_RAT P33533 CHEMBL269 Delta opioid receptor 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
OPRK_RAT P34975 CHEMBL3614 Kappa opioid receptor 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
OPRM_RAT P33535 CHEMBL270 Mu opioid receptor 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
Q9WTR4_RAT Q9WTR4 CHEMBL304 Norepinephrine transporter 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
SC6A2_HUMAN P23975 CHEMBL222 Norepinephrine transporter 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT1B_RAT P28564 CHEMBL3459 Serotonin 1b (5-HT1b) receptor 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT1D_RAT P28565 CHEMBL5450 Serotonin 1d (5-HT1d) receptor 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT1F_RAT P30940 CHEMBL4646 Serotonin 1f (5-HT1f) receptor 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT2B_HUMAN P41595 CHEMBL1833 Serotonin 2b (5-HT2b) receptor 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT2B_RAT P30994 CHEMBL323 Serotonin 2b (5-HT2b) receptor 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT2C_RAT P08909 CHEMBL324 Serotonin 2c (5-HT2c) receptor 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACHA2_RAT P12389 CHEMBL2584 Neuronal acetylcholine receptor protein alpha-2 subunit 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACHA4_MOUSE O70174 CHEMBL4457 Neuronal acetylcholine receptor protein alpha-4 subunit 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACHA5_RAT P20420 CHEMBL4960 Neuronal acetylcholine receptor protein alpha-5 subunit 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACHA6_RAT P43143 CHEMBL4747 Neuronal acetylcholine receptor protein alpha-6 subunit 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACHA7_HUMAN P36544 CHEMBL2492 Neuronal acetylcholine receptor protein alpha-7 subunit 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACHA7_RAT Q05941 CHEMBL4980 Neuronal acetylcholine receptor protein alpha-7 subunit 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACHA9_RAT P43144 CHEMBL2585 Neuronal acetylcholine receptor protein alpha-9 subunit 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACHA_RAT P25108 CHEMBL3599 Acetylcholine receptor protein alpha chain 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACHA_TORCA P02710 CHEMBL3097 Acetylcholine receptor protein alpha chain 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACHB2_RAT P12390 CHEMBL3001 Neuronal acetylcholine receptor protein beta-2 subunit 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACHB3_RAT P12391 CHEMBL4568 Neuronal acetylcholine receptor protein beta-3 subunit 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACHB4_RAT P12392 CHEMBL2658 Neuronal acetylcholine receptor protein beta-4 subunit 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACHB_RAT P25109 CHEMBL2666 Acetylcholine receptor protein beta chain 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACHB_TORCA P02712 CHEMBL3803 Acetylcholine receptor protein beta chain 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACHD_TORCA P02718 CHEMBL3916 Acetylcholine receptor protein delta chain 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACHG_TORCA P02714 CHEMBL4019 Acetylcholine receptor protein gamma chain 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACM2_HUMAN P08172 CHEMBL211 Muscarinic acetylcholine receptor M2 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
ADA2A_HUMAN P08913 CHEMBL1867 Alpha-2a adrenergic receptor 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
ANDR_HUMAN P10275 CHEMBL1871 Androgen Receptor 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
DRD3_HUMAN P35462 CHEMBL234 Dopamine D3 receptor 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
OPRK_CAVPO P41144 CHEMBL3952 Kappa opioid receptor 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
Q63380_RAT Q63380 CHEMBL6184 Transporter 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
Q8BGP7_MOUSE Q8BGP7 CHEMBL2235 Neuronal acetylcholine receptor protein beta-2 subunit 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
SC6A4_RAT P31652 CHEMBL313 Serotonin transporter 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
Z104283 Z104283 CHEMBL1907589 Neuronal acetylcholine receptor; alpha4/beta2 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z104290 Z104290 CHEMBL1907596 Neuronal acetylcholine receptor; alpha4/beta2 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50597 Z50597 CHEMBL376 Rattus norvegicus 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT3A_HUMAN P46098 CHEMBL1899 Serotonin 3a (5-HT3a) receptor 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT4R_RAT Q62758 CHEMBL4317 Serotonin 4 (5-HT4) receptor 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT5A_RAT P35364 CHEMBL4655 Serotonin 5a (5-HT5a) receptor 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT5B_RAT P35365 CHEMBL2619 Serotonin 5b (5-HT5b) receptor 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT6R_RAT P31388 CHEMBL3372 Serotonin 6 (5-HT6) receptor 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT7R_HUMAN P34969 CHEMBL3155 Serotonin 7 (5-HT7) receptor 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT7R_RAT P32305 CHEMBL3223 Serotonin 7 (5-HT7) receptor 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACM1_HUMAN P11229 CHEMBL216 Muscarinic acetylcholine receptor M1 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACM1_RAT P08482 CHEMBL276 Muscarinic acetylcholine receptor M1 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
ADA1A_HUMAN P35348 CHEMBL229 Alpha-1a adrenergic receptor 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADA1B_HUMAN P35368 CHEMBL232 Alpha-1b adrenergic receptor 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADA1B_RAT P15823 CHEMBL315 Alpha-1b adrenergic receptor 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADA1D_HUMAN P25100 CHEMBL223 Alpha-1d adrenergic receptor 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADA1D_RAT P23944 CHEMBL326 Alpha-1d adrenergic receptor 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADA2A_RAT P22909 CHEMBL327 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
ADA2B_RAT P19328 CHEMBL266 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
ADA2C_RAT P22086 CHEMBL314 Alpha-2c adrenergic receptor 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADCY1_HUMAN Q08828 CHEMBL2899 Brain adenylate cyclase 1 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADCY2_HUMAN Q08462 CHEMBL3760 Adenylate cyclase type II 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADCY8_HUMAN P40145 CHEMBL2960 Adenylate cyclase type VIII 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADRB1_RAT P18090 CHEMBL3252 Beta-1 adrenergic receptor 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADRB2_RAT P10608 CHEMBL3754 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
AGTR2_RAT P35351 CHEMBL257 Angiotensin II type 2 (AT-2) receptor 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
AGTRA_RAT P25095 CHEMBL329 Angiotensin II type 1a (AT-1a) receptor 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
AGTRB_RAT P29089 CHEMBL263 Angiotensin II type 1b (AT-1b) receptor 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH4_HUMAN P22748 CHEMBL3729 Carbonic anhydrase IV 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
DRD1_HUMAN P21728 CHEMBL2056 Dopamine D1 receptor 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
DRD2_RAT P61169 CHEMBL339 Dopamine D2 receptor 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
DRD4_HUMAN P21917 CHEMBL219 Dopamine D4 receptor 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
EPYC_HUMAN Q99645 CHEMBL2080 Small chondroitin/dermatan sulfate proteoglycan 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ESR1_RAT P06211 CHEMBL2724 Estrogen receptor alpha 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ESR2_RAT Q62986 CHEMBL3021 Estrogen receptor beta 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
HRH1_RAT P31390 CHEMBL4701 Histamine H1 receptor 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
IMDH1_HUMAN P20839 CHEMBL1822 Inosine-5'-monophosphate dehydrogenase 1 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
IMDH2_HUMAN P12268 CHEMBL2002 Inosine-5'-monophosphate dehydrogenase 2 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
OPRD_PIG P79291 CHEMBL4103 Delta opioid receptor 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
OPRM_CAVPO P97266 CHEMBL4354 Mu opioid receptor 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
OPRM_MOUSE P42866 CHEMBL2858 Mu opioid receptor 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
OPRX_HUMAN P41146 CHEMBL2014 Nociceptin receptor 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
PGH1_HUMAN P23219 CHEMBL221 Cyclooxygenase-1 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
PGH2_MOUSE Q05769 CHEMBL4321 Cyclooxygenase-2 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Q72547_9HIV1 Q72547 CHEMBL247 Human immunodeficiency virus type 1 reverse transcriptase 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
SGMR1_CAVPO Q60492 CHEMBL4153 Sigma-1 receptor 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
TYSY_MOUSE P07607 CHEMBL3160 Thymidylate synthase 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z100251 Z100251 CHEMBL612442 Monoclonal antibody (mAb) 2E2 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z100491 Z100491 CHEMBL613288 Sigma 2 receptor 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z104281 Z104281 CHEMBL1907587 Neuronal acetylcholine receptor; alpha3/beta2 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z104304 Z104304 CHEMBL1907610 Adrenergic receptor alpha-1 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT3B_HUMAN O95264 CHEMBL3895 Serotonin 3b (5-HT3b) receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT3C_HUMAN Q8WXA8 CHEMBL4795 Serotonin 3c (5-HT3c) receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT3D_HUMAN Q70Z44 CHEMBL4673 Serotonin 3d (5-HT3d) receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT3E_HUMAN A5X5Y0 CHEMBL3812 Serotonin 3e (5-HT3e) receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT5A_HUMAN P47898 CHEMBL3426 Serotonin 5a (5-HT5a) receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
A2AMW3_MOUSE A2AMW3 CHEMBL3121 GABA receptor epsilon subunit 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
AA1R_HUMAN P30542 CHEMBL226 Adenosine A1 receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
AA1R_RAT P25099 CHEMBL318 Adenosine A1 receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
AA2AR_HUMAN P29274 CHEMBL251 Adenosine A2a receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
AA2AR_RAT P30543 CHEMBL302 Adenosine A2a receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
AA2BR_RAT P29276 CHEMBL2592 Adenosine A2b receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
AA3R_HUMAN P33765 CHEMBL256 Adenosine A3 receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
AA3R_RAT P28647 CHEMBL3360 Adenosine A3 receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ABL1_HUMAN P00519 CHEMBL1862 Tyrosine-protein kinase ABL 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACES_BOVIN P23795 CHEMBL4768 Acetylcholinesterase 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACES_HUMAN P22303 CHEMBL220 Acetylcholinesterase 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACE_HUMAN P12821 CHEMBL1808 Angiotensin-converting enzyme 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACE_RAT P47820 CHEMBL2625 Angiotensin-converting enzyme 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACHA2_HUMAN Q15822 CHEMBL1794 Neuronal acetylcholine receptor protein alpha-2 subunit 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACHA3_HUMAN P32297 CHEMBL3068 Neuronal acetylcholine receptor protein alpha-3 subunit 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACHA4_HUMAN P43681 CHEMBL1882 Neuronal acetylcholine receptor protein alpha-4 subunit 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACHA7_MOUSE P49582 CHEMBL3365 Neuronal acetylcholine receptor protein alpha-7 subunit 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACHB2_HUMAN P17787 CHEMBL1883 Neuronal acetylcholine receptor protein beta-2 subunit 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACHB4_HUMAN P30926 CHEMBL3002 Neuronal acetylcholine receptor protein beta-4 subunit 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACHP_LYMST P58154 CHEMBL6084 Acetylcholine-binding protein 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADCY2_RAT P26769 CHEMBL2958 Adenylate cyclase type II 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADCY3_RAT P21932 CHEMBL4864 Adenylate cyclase type III 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADCY4_RAT P26770 CHEMBL2879 Adenylate cyclase type IV 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADCY5_RAT Q04400 CHEMBL2880 Adenylate cyclase type V 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADCY6_RAT Q03343 CHEMBL2975 Adenylate cyclase type VI 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADCY8_RAT P40146 CHEMBL3082 Adenylate cyclase type VIII 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
AGTR1_BOVIN P25104 CHEMBL3374 Angiotensin II type 1a (AT-1a) receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
AGTR1_HUMAN P30556 CHEMBL227 Angiotensin II type 1 receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
AGTR2_HUMAN P50052 CHEMBL4607 Angiotensin II type 2 (AT-2) receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ANDR_RAT P15207 CHEMBL3072 Androgen Receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH10_HUMAN Q9NS85 CHEMBL4645 Carbonic anhydrase-related protein 10 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH11_HUMAN O75493 CHEMBL2420 Carbonic anhydrase-related protein 2 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
CAH1_HUMAN P00915 CHEMBL261 Carbonic anhydrase I 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH2_HUMAN P00918 CHEMBL205 Carbonic anhydrase II 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH3_HUMAN P07451 CHEMBL2885 Carbonic anhydrase III 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
CAH8_HUMAN P35219 CHEMBL2410 Carbonic anhydrase-related protein 8 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH9_HUMAN Q16790 CHEMBL3594 Carbonic anhydrase IX 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CHLE_HUMAN P06276 CHEMBL1914 Butyrylcholinesterase 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CP19A_HUMAN P11511 CHEMBL1978 Cytochrome P450 19A1 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
DHB1_HUMAN P14061 CHEMBL3181 Estradiol 17-beta-dehydrogenase 1 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
DNM3B_HUMAN Q9UBC3 CHEMBL6095 DNA (cytosine-5)-methyltransferase 3B 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
DNMT1_HUMAN P26358 CHEMBL1993 DNA (cytosine-5)-methyltransferase 1 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
DRTS_PLAFK P13922 CHEMBL1939 Dihydrofolate reductase 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
DYR_HUMAN P00374 CHEMBL202 Dihydrofolate reductase 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
DYR_PNECA P16184 CHEMBL1926 Dihydrofolate reductase 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
DYR_RAT Q920D2 CHEMBL2363 Dihydrofolate reductase 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ERR1_HUMAN P11474 CHEMBL3429 Estrogen-related receptor alpha 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ERR2_HUMAN O95718 CHEMBL3751 Estrogen-related receptor beta 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ERR3_HUMAN P62508 CHEMBL4245 Estrogen-related receptor gamma 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ESR1_BOVIN P49884 CHEMBL2930 Estrogen receptor alpha 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ESR1_MOUSE P19785 CHEMBL3065 Estrogen receptor alpha 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ESR2_MOUSE O08537 CHEMBL2995 Estrogen receptor beta 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
F16P1_HUMAN P09467 CHEMBL3975 Fructose-1,6-bisphosphatase 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
FYN_HUMAN P06241 CHEMBL1841 Tyrosine-protein kinase FYN 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
GBRA1_MOUSE P62812 CHEMBL3139 GABA receptor alpha-1 subunit 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
GBRA2_MOUSE P26048 CHEMBL2705 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_MOUSE P26049 CHEMBL3387 GABA receptor alpha-3 subunit 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
GBRA4_MOUSE Q9D6F4 CHEMBL4182 GABA receptor alpha-4 subunit 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
GBRA5_MOUSE Q8BHJ7 CHEMBL2304 GABA receptor alpha-5 subunit 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
GBRA6_MOUSE P16305 CHEMBL4710 GABA receptor alpha-6 subunit 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
GBRB1_MOUSE P50571 CHEMBL2839 GABA receptor beta-1 subunit 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
GBRB3_MOUSE P63080 CHEMBL4231 GABA receptor beta-3 subunit 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
GBRD_MOUSE P22933 CHEMBL3907 GABA receptor delta subunit 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
GBRG1_MOUSE Q9R0Y8 CHEMBL2891 GABA receptor gamma-1 subunit 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
GBRG2_MOUSE P22723 CHEMBL2941 GABA receptor gamma-2 subunit 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
GBRG3_MOUSE P27681 CHEMBL4236 GABA receptor gamma-3 subunit 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
GBRP_MOUSE Q8QZW7 CHEMBL2746 GABA receptor pi subunit 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
GBRT_MOUSE Q9JLF1 CHEMBL3249 GABA receptor theta subunit 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
GCR_HUMAN P04150 CHEMBL2034 Glucocorticoid receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
GCR_MOUSE P06537 CHEMBL3144 Glucocorticoid receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
GLNA_HUMAN P15104 CHEMBL4612 Glutamine synthetase 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
GPER_HUMAN Q99527 CHEMBL5872 G-protein coupled estrogen receptor 1 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
GSTK1_HUMAN Q9Y2Q3 CHEMBL4491 Glutathione S-transferase kappa 1 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
KCNH2_HUMAN Q12809 CHEMBL240 HERG 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
LCK_HUMAN P06239 CHEMBL258 Tyrosine-protein kinase LCK 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
MCR_HUMAN P08235 CHEMBL1994 Mineralocorticoid receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
MCR_RAT P22199 CHEMBL3507 Mineralocorticoid receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
MTOR_HUMAN P42345 CHEMBL2842 FK506 binding protein 12 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
NISCH_HUMAN Q9Y2I1 CHEMBL3923 Nischarin 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
OPRD_MOUSE P32300 CHEMBL3222 Delta opioid receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
OPRK_MOUSE P33534 CHEMBL4329 Kappa opioid receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
OPRM_BOVIN P79350 CHEMBL3041 Mu opioid receptor 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
PGH1_SHEEP P05979 CHEMBL2949 Cyclooxygenase-1 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
PGH2_HUMAN P35354 CHEMBL230 Cyclooxygenase-2 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
PI4KB_HUMAN Q9UBF8 CHEMBL3268 PI4-kinase beta subunit 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
PK3CD_HUMAN O00329 CHEMBL3130 PI3-kinase p110-delta subunit 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
PLD2_HUMAN O14939 CHEMBL2734 Phospholipase D2 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
PRGR_RABIT P06186 CHEMBL3456 Progesterone receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
PRKDC_HUMAN P78527 CHEMBL3142 DNA-dependent protein kinase 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
PYRD_HUMAN Q02127 CHEMBL1966 Dihydroorotate dehydrogenase 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
PYRD_MOUSE O35435 CHEMBL2991 Dihydroorotate dehydrogenase 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
PYRD_RAT Q63707 CHEMBL2383 Dihydroorotate dehydrogenase 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Q72874_9HIV1 Q72874 CHEMBL243 Human immunodeficiency virus type 1 protease 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
S22A6_MOUSE Q8VC69 CHEMBL5653 Solute carrier family 22 member 6 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
SC6A3_HUMAN Q01959 CHEMBL238 Dopamine transporter 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
SGMR1_MOUSE O55242 CHEMBL3465 Sigma opioid receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
SHBG_HUMAN P04278 CHEMBL3305 Testis-specific androgen-binding protein 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
SRC_HUMAN P12931 CHEMBL267 Tyrosine-protein kinase SRC 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
THYX_MYCTU P66930 CHEMBL1795161 Thymidylate synthase thyX 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
TOP1_HUMAN P11387 CHEMBL1781 DNA topoisomerase I 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
TRPA1_HUMAN O75762 CHEMBL6007 Transient receptor potential cation channel subfamily A member 1 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
TYSY_MYCTU P67044 CHEMBL1795162 Thymidylate synthase 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
VMAT2_RAT Q01827 CHEMBL4828 Synaptic vesicular amine transporter 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z104284 Z104284 CHEMBL1907590 Neuronal acetylcholine receptor; alpha2/beta4 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z104285 Z104285 CHEMBL1907591 Neuronal acetylcholine receptor; alpha4/beta4 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z104286 Z104286 CHEMBL1907592 Neuronal acetylcholine receptor; alpha2/beta2 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z104287 Z104287 CHEMBL1907593 Neuronal acetylcholine receptor; alpha3/beta4 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z104288 Z104288 CHEMBL1907594 Neuronal acetylcholine receptor; alpha3/beta4 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z104289 Z104289 CHEMBL1907595 Neuronal acetylcholine receptor; alpha4/beta4 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z104301 Z104301 CHEMBL1907607 GABA-A receptor; anion channel 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50594 Z50594 CHEMBL375 Mus musculus 1 Annotations Catalogs SMILES SDF Mol2 Flexibase