UCSF

IBScreen NP

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

Binding 10μM Targets with Highest Number of Available Compounds (543 in total)

Name (Uniprot) Swissprot ChEMBL Description Size Browse Download (Annotations)
CAH12_HUMAN O43570 CHEMBL3242 Carbonic anhydrase XII 15 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH2_HUMAN P00918 CHEMBL205 Carbonic anhydrase II 15 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH1_HUMAN P00915 CHEMBL261 Carbonic anhydrase I 14 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH9_HUMAN Q16790 CHEMBL3594 Carbonic anhydrase IX 13 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH5A_HUMAN P35218 CHEMBL4789 Carbonic anhydrase VA 12 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH6_HUMAN P23280 CHEMBL3025 Carbonic anhydrase VI 12 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH14_HUMAN Q9ULX7 CHEMBL3510 Carbonic anhydrase XIV 11 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH7_HUMAN P43166 CHEMBL2326 Carbonic anhydrase VII 11 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT2A_RAT P14842 CHEMBL322 Serotonin 2a (5-HT2a) receptor 10 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH3_HUMAN P07451 CHEMBL2885 Carbonic anhydrase III 10 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH4_HUMAN P22748 CHEMBL3729 Carbonic anhydrase IV 10 Annotations Catalogs SMILES SDF Mol2 Flexibase
AOFA_HUMAN P21397 CHEMBL1951 Monoamine oxidase A 9 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH5B_HUMAN Q9Y2D0 CHEMBL3969 Carbonic anhydrase VB 9 Annotations Catalogs SMILES SDF Mol2 Flexibase
CP19A_HUMAN P11511 CHEMBL1978 Cytochrome P450 19A1 9 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT1A_RAT P19327 CHEMBL273 Serotonin 1a (5-HT1a) receptor 8 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT2C_RAT P08909 CHEMBL324 Serotonin 2c (5-HT2c) receptor 8 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADA2A_RAT P22909 CHEMBL327 Alpha-2a adrenergic receptor 8 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADA2B_RAT P19328 CHEMBL266 Alpha-2b adrenergic receptor 8 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADA2C_RAT P22086 CHEMBL314 Alpha-2c adrenergic receptor 8 Annotations Catalogs SMILES SDF Mol2 Flexibase
ANDR_HUMAN P10275 CHEMBL1871 Androgen Receptor 8 Annotations Catalogs SMILES SDF Mol2 Flexibase
Q7ZJM1_9HIV1 Q7ZJM1 CHEMBL3471 Human immunodeficiency virus type 1 integrase 8 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z104301 Z104301 CHEMBL1907607 GABA-A receptor; anion channel 8 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT1B_RAT P28564 CHEMBL3459 Serotonin 1b (5-HT1b) receptor 7 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT2B_RAT P30994 CHEMBL323 Serotonin 2b (5-HT2b) receptor 7 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT7R_HUMAN P34969 CHEMBL3155 Serotonin 7 (5-HT7) receptor 7 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH13_MOUSE Q9D6N1 CHEMBL2186 Carbonic anhydrase XIII 7 Annotations Catalogs SMILES SDF Mol2 Flexibase
ESR2_HUMAN Q92731 CHEMBL242 Estrogen receptor beta 7 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z104283 Z104283 CHEMBL1907589 Neuronal acetylcholine receptor; alpha4/beta2 7 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50597 Z50597 CHEMBL376 Rattus norvegicus 7 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT1D_RAT P28565 CHEMBL5450 Serotonin 1d (5-HT1d) receptor 6 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT1F_RAT P30940 CHEMBL4646 Serotonin 1f (5-HT1f) receptor 6 Annotations Catalogs SMILES SDF Mol2 Flexibase
AA2AR_HUMAN P29274 CHEMBL251 Adenosine A2a receptor 6 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACES_HUMAN P22303 CHEMBL220 Acetylcholinesterase 6 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACHA7_HUMAN P36544 CHEMBL2492 Neuronal acetylcholine receptor protein alpha-7 subunit 6 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADA2C_HUMAN P18825 CHEMBL1916 Alpha-2c adrenergic receptor 6 Annotations Catalogs SMILES SDF Mol2 Flexibase
AOFB_HUMAN P27338 CHEMBL2039 Monoamine oxidase B 6 Annotations Catalogs SMILES SDF Mol2 Flexibase
DRD2_HUMAN P14416 CHEMBL217 Dopamine D2 receptor 6 Annotations Catalogs SMILES SDF Mol2 Flexibase
DRD2_RAT P61169 CHEMBL339 Dopamine D2 receptor 6 Annotations Catalogs SMILES SDF Mol2 Flexibase
GCR_HUMAN P04150 CHEMBL2034 Glucocorticoid receptor 6 Annotations Catalogs SMILES SDF Mol2 Flexibase
OPRM_RAT P33535 CHEMBL270 Mu opioid receptor 6 Annotations Catalogs SMILES SDF Mol2 Flexibase
SGMR1_RAT Q9R0C9 CHEMBL3602 Sigma opioid receptor 6 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT1A_HUMAN P08908 CHEMBL214 Serotonin 1a (5-HT1a) receptor 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT1D_HUMAN P28221 CHEMBL1983 Serotonin 1d (5-HT1d) receptor 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT2C_HUMAN P28335 CHEMBL225 Serotonin 2c (5-HT2c) receptor 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT6R_HUMAN P50406 CHEMBL3371 Serotonin 6 (5-HT6) receptor 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
AA1R_RAT P25099 CHEMBL318 Adenosine A1 receptor 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
AA2AR_RAT P30543 CHEMBL302 Adenosine A2a receptor 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
AA3R_HUMAN P33765 CHEMBL256 Adenosine A3 receptor 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
ADA2A_HUMAN P08913 CHEMBL1867 Alpha-2a adrenergic receptor 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADRB1_RAT P18090 CHEMBL3252 Beta-1 adrenergic receptor 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADRB2_CANFA P54833 CHEMBL2289 Beta-2 adrenergic receptor 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
ALDR_RAT P07943 CHEMBL2622 Aldose reductase 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH15_MOUSE Q99N23 CHEMBL5973 Carbonic anhydrase 15 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
DHB3_HUMAN P37058 CHEMBL4234 Estradiol 17-beta-dehydrogenase 3 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
DRD1_RAT P18901 CHEMBL265 Dopamine D1 receptor 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
DRD3_RAT P19020 CHEMBL3138 Dopamine D3 receptor 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
DRD4_HUMAN P21917 CHEMBL219 Dopamine D4 receptor 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
ESR1_HUMAN P03372 CHEMBL206 Estrogen receptor alpha 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
KCNH2_HUMAN Q12809 CHEMBL240 HERG 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
OPRD_RAT P33533 CHEMBL269 Delta opioid receptor 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
OPRK_RAT P34975 CHEMBL3614 Kappa opioid receptor 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
Q2PCB5_DICLA Q2PCB5 CHEMBL1795125 Carbonic anhydrase 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z104290 Z104290 CHEMBL1907596 Neuronal acetylcholine receptor; alpha4/beta2 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z104304 Z104304 CHEMBL1907610 Adrenergic receptor alpha-1 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT1B_HUMAN P28222 CHEMBL1898 Serotonin 1b (5-HT1b) receptor 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
ABCG2_HUMAN Q9UNQ0 CHEMBL5393 ATP-binding cassette sub-family G member 2 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACES_ELEEL O42275 CHEMBL4078 Acetylcholinesterase 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACE_HUMAN P12821 CHEMBL1808 Angiotensin-converting enzyme 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACE_RAT P47820 CHEMBL2625 Angiotensin-converting enzyme 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACH10_RAT Q9JLB5 CHEMBL3461 Neuronal acetylcholine receptor protein alpha-10 subunit 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADA2B_HUMAN P18089 CHEMBL1942 Alpha-2b adrenergic receptor 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
AOFA_RAT P21396 CHEMBL3358 Monoamine oxidase A 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
APEX1_HUMAN P27695 CHEMBL5619 DNA-(apurinic or apyrimidinic site) lyase 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
CP17A_HUMAN P05093 CHEMBL3522 Cytochrome P450 17A1 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
CP51_MYCTU P0A512 CHEMBL5090 Lanosterol 14-alpha demethylase 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
DYR_HUMAN P00374 CHEMBL202 Dihydrofolate reductase 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
ICMT_HUMAN O60725 CHEMBL4699 Isoprenylcysteine carboxyl methyltransferase 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
PDE5A_HUMAN O76074 CHEMBL1827 Phosphodiesterase 5A 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
PPAC_BOVIN P11064 CHEMBL1075054 Low molecular weight phosphotyrosine protein phosphatase 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
PRGR_HUMAN P06401 CHEMBL208 Progesterone receptor 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
Q72547_9HIV1 Q72547 CHEMBL247 Human immunodeficiency virus type 1 reverse transcriptase 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
SGMR1_HUMAN Q99720 CHEMBL287 Sigma opioid receptor 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT2A_HUMAN P28223 CHEMBL224 Serotonin 2a (5-HT2a) 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
AA2BR_RAT P29276 CHEMBL2592 Adenosine A2b 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
ACHA7_RAT Q05941 CHEMBL4980 Neuronal acetylcholine receptor protein alpha-7 subunit 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
ACHB4_RAT P12392 CHEMBL2658 Neuronal acetylcholine receptor protein beta-4 subunit 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACM1_RAT P08482 CHEMBL276 Muscarinic acetylcholine receptor M1 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADA1A_HUMAN P35348 CHEMBL229 Alpha-1a adrenergic receptor 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADA1B_HUMAN P35368 CHEMBL232 Alpha-1b adrenergic receptor 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADA1B_RAT P15823 CHEMBL315 Alpha-1b adrenergic receptor 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADA1D_HUMAN P25100 CHEMBL223 Alpha-1d adrenergic receptor 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADA1D_RAT P23944 CHEMBL326 Alpha-1d adrenergic receptor 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADCY2_RAT P26769 CHEMBL2958 Adenylate cyclase type II 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADCY3_RAT P21932 CHEMBL4864 Adenylate cyclase type III 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADCY4_RAT P26770 CHEMBL2879 Adenylate cyclase type IV 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADCY5_RAT Q04400 CHEMBL2880 Adenylate cyclase type V 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADCY6_RAT Q03343 CHEMBL2975 Adenylate cyclase type VI 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADCY8_RAT P40146 CHEMBL3082 Adenylate cyclase type VIII 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADRB2_HUMAN P07550 CHEMBL210 Beta-2 adrenergic receptor 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADRB3_RAT P26255 CHEMBL4031 Beta-3 adrenergic receptor 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
AOFB_RAT P19643 CHEMBL2993 Monoamine oxidase B 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAC1C_RAT P22002 CHEMBL3762 Voltage-gated L-type calcium channel alpha-1C subunit 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
CHLE_HORSE P81908 CHEMBL5763 Cholinesterase 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
CHLE_HUMAN P06276 CHEMBL1914 Butyrylcholinesterase 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
CP1B1_HUMAN Q16678 CHEMBL4878 Cytochrome P450 1B1 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
DHI1_HUMAN P28845 CHEMBL4235 11-beta-hydroxysteroid dehydrogenase 1 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
DRD1_HUMAN P21728 CHEMBL2056 Dopamine D1 receptor 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
DRD2_BOVIN P20288 CHEMBL3998 Dopamine D2 receptor 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
DRD3_HUMAN P35462 CHEMBL234 Dopamine D3 receptor 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
GABR1_RAT Q9Z0U4 CHEMBL2753 GABA-B receptor 1 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
GABR2_RAT O88871 CHEMBL4686 GABA-B receptor 2 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
GBRA1_BOVIN P08219 CHEMBL3627 GABA receptor alpha-1 subunit 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
GBRA2_BOVIN P10063 CHEMBL2321 GABA receptor alpha-2 subunit 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
GBRA3_BOVIN P10064 CHEMBL3628 GABA receptor alpha-3 subunit 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
GBRA4_BOVIN P20237 CHEMBL3140 GABA receptor alpha-4 subunit 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
GBRB1_BOVIN P08220 CHEMBL2848 GABA receptor beta-1 subunit 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
GBRG2_BOVIN P22300 CHEMBL5138 GABA receptor gamma-2 subunit 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
NISCH_HUMAN Q9Y2I1 CHEMBL3923 Nischarin 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
NQO1_HUMAN P15559 CHEMBL3623 Quinone reductase 1) 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
OPRM_HUMAN P35372 CHEMBL233 Mu opioid receptor 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
PGH2_HUMAN P35354 CHEMBL230 Cyclooxygenase-2 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
SRC_HUMAN P12931 CHEMBL267 Tyrosine-protein kinase SRC 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
TBB1_HUMAN Q9H4B7 CHEMBL1915 Tubulin beta-1 chain 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
TYRO_AGABI O42713 CHEMBL3318 Tyrosinase 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z104302 Z104302 CHEMBL1907608 Glutamate NMDA receptor 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT2B_HUMAN P41595 CHEMBL1833 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
5HT3A_HUMAN P46098 CHEMBL1899 Serotonin 3a (5-HT3a) receptor 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT3A_RAT P35563 CHEMBL2411 Serotonin 3a (5-HT3a) receptor 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT3B_RAT Q9JJ16 CHEMBL3458 Serotonin 3b (5-HT3b) receptor 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT4R_HUMAN Q13639 CHEMBL1875 Serotonin 4 (5-HT4) receptor 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT5A_HUMAN P47898 CHEMBL3426 Serotonin 5a (5-HT5a) 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
A1E3K9_ECOLX A1E3K9 CHEMBL1075073 Beta-lactamase SCO-1 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
A2RP81_CITFR A2RP81 CHEMBL5303 PER-2 beta-lactamase 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
A8RR46_BACCS A8RR46 CHEMBL5439 Beta-lactamase 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
AA1R_BOVIN P28190 CHEMBL4975 Adenosine A1 receptor 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
AA2BR_HUMAN P29275 CHEMBL255 Adenosine A2b receptor 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
AA3R_RAT P28647 CHEMBL3360 Adenosine A3 receptor 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACES_BOVIN P23795 CHEMBL4768 Acetylcholinesterase 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACES_RAT P37136 CHEMBL3199 Acetylcholinesterase 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACES_TORCA P04058 CHEMBL4780 Acetylcholinesterase 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACHA4_HUMAN P43681 CHEMBL1882 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
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
ACHB3_RAT P12391 CHEMBL4568 Neuronal acetylcholine receptor protein beta-3 subunit 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACHB4_HUMAN P30926 CHEMBL3002 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_HUMAN Q07001 CHEMBL3011 Acetylcholine receptor protein delta 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
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_BOVIN P18130 CHEMBL4892 Alpha-1a adrenergic receptor 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADA1A_RAT P43140 CHEMBL319 Alpha-1a adrenergic receptor 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADA2A_BOVIN Q28838 CHEMBL4744 Alpha-2a adrenergic receptor 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADA2A_MOUSE Q01338 CHEMBL4075 Alpha-2a adrenergic receptor 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADA2B_BOVIN O77700 CHEMBL3523 Alpha-2b adrenergic receptor 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADA2B_MOUSE P30545 CHEMBL2405 Alpha-2b adrenergic receptor 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADA2C_MOUSE Q01337 CHEMBL4826 Alpha-2c adrenergic receptor 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADRB2_BOVIN Q28044 CHEMBL3373 Beta-2 adrenergic receptor 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADRB2_MESAU P04274 CHEMBL5943 Beta-2 adrenergic receptor 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ALDR_HUMAN P15121 CHEMBL1900 Aldose reductase 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
AMPC_ECOLI P00811 CHEMBL2026 Beta-lactamase 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
AMPC_ENTCL P05364 CHEMBL2725 Beta-lactamase 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
AMPL_HUMAN P28838 CHEMBL3965 Leucine aminopeptidase 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
CAH13_HUMAN Q8N1Q1 CHEMBL3912 Carbonic anhydrase XIII 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
CSK21_HUMAN P68400 CHEMBL3629 Casein kinase II alpha 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
D1MIX9_PSEAI D1MIX9 CHEMBL1250341 Beta-lactamase GES-13 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
DRD1_BOVIN Q95136 CHEMBL2967 Dopamine D1 receptor 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
DRD5_HUMAN P21918 CHEMBL1850 Dopamine D5 receptor 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
EGFR_HUMAN P00533 CHEMBL203 Epidermal growth factor receptor erbB1 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
G6PD_HUMAN P11413 CHEMBL5347 Glucose-6-phosphate 1-dehydrogenase 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
GBRA2_HUMAN P47869 CHEMBL4956 GABA receptor alpha-2 subunit 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
GBRA2_RAT P23576 CHEMBL341 GABA receptor alpha-2 subunit 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
GBRB2_HUMAN P47870 CHEMBL1920 GABA receptor beta-2 subunit 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
GBRG1_RAT P23574 CHEMBL296 GABA receptor gamma-1 subunit 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
GBRG2_HUMAN P18507 CHEMBL1788 GABA receptor gamma-2 subunit 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
GSK3B_HUMAN P49841 CHEMBL262 Glycogen synthase kinase-3 beta 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
LCK_HUMAN P06239 CHEMBL258 Tyrosine-protein kinase LCK 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
LOX5_RAT P12527 CHEMBL312 Arachidonate 5-lipoxygenase 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
M3K5_HUMAN Q99683 CHEMBL5285 Mitogen-activated protein kinase kinase kinase 5 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
MAPK2_HUMAN P49137 CHEMBL2208 MAP kinase-activated protein kinase 2 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
MCR_HUMAN P08235 CHEMBL1994 Mineralocorticoid receptor 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
MRP1_HUMAN P33527 CHEMBL3004 Multidrug resistance-associated protein 1 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
MTR1A_CHICK P49285 CHEMBL4555 Melatonin receptor 1A 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
MTR1A_HUMAN P48039 CHEMBL1945 Melatonin receptor 1A 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
MTR1B_CHICK P51050 CHEMBL4466 Melatonin receptor 1B 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
MTR1B_HUMAN P49286 CHEMBL1946 Melatonin receptor 1B 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
MTR1C_CHICK P49288 CHEMBL3196 Melatonin receptor 1C 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
OXDA_HUMAN P14920 CHEMBL5485 D-amino-acid oxidase 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
P85A_HUMAN P27986 CHEMBL2506 PI3-kinase p85-alpha subunit 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
P85B_HUMAN O00459 CHEMBL4437 PI3-kinase p85-beta subunit 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
PDE5A_BOVIN Q28156 CHEMBL3478 Phosphodiesterase 5A 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
PGH1_HUMAN P23219 CHEMBL221 Cyclooxygenase-1 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
PIM1_HUMAN P11309 CHEMBL2147 Serine/threonine-protein kinase PIM1 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
PRGR_RABIT P06186 CHEMBL3456 Progesterone receptor 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Q3I4V7_CRYNV Q3I4V7 CHEMBL1697676 Carbonic anhydrase 2 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Q5AJ71_CANAL Q5AJ71 CHEMBL5337 Carbonic anhydrase 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Q72874_9HIV1 Q72874 CHEMBL243 Human immunodeficiency virus type 1 protease 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Q9GRG7_9TRYP Q9GRG7 CHEMBL5672 Glucose-6-phosphate 1-dehydrogenase 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Q9JKC1_RAT Q9JKC1 CHEMBL3403 Butyrylcholinesterase 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
S1PR1_HUMAN P21453 CHEMBL4333 Sphingosine 1-phosphate receptor Edg-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
S5A1_HUMAN P18405 CHEMBL1787 Steroid 5-alpha-reductase 1 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
S5A1_RAT P24008 CHEMBL3422 Steroid 5-alpha-reductase 1 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
S5A2_HUMAN P31213 CHEMBL1856 Steroid 5-alpha-reductase 2 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
S5A2_RAT P31214 CHEMBL5099 Steroid 5-alpha-reductase 2 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
SC6A3_RAT P23977 CHEMBL338 Dopamine transporter 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
SC6A4_RAT P31652 CHEMBL313 Serotonin transporter 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
SIRT1_HUMAN Q96EB6 CHEMBL4506 NAD-dependent deacetylase sirtuin 1 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
TA2R_HUMAN P21731 CHEMBL2069 Thromboxane A2 receptor 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
TBA1A_RAT P68370 CHEMBL4139 Tubulin alpha-1 chain 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z104281 Z104281 CHEMBL1907587 Neuronal acetylcholine receptor; alpha3/beta2 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z104282 Z104282 CHEMBL1907588 Acetylcholine receptor; alpha1/beta1/delta/gamma 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z104284 Z104284 CHEMBL1907590 Neuronal acetylcholine receptor; alpha2/beta4 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z104286 Z104286 CHEMBL1907592 Neuronal acetylcholine receptor; alpha2/beta2 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z104287 Z104287 CHEMBL1907593 Neuronal acetylcholine receptor; alpha3/beta4 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z104288 Z104288 CHEMBL1907594 Neuronal acetylcholine receptor; alpha3/beta4 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z104289 Z104289 CHEMBL1907595 Neuronal acetylcholine receptor; alpha4/beta4 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z104303 Z104303 CHEMBL1907609 Muscarinic acetylcholine receptor 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
3BHS2_RAT P22072 CHEMBL4821 3-beta-hydroxysteroid dehydrogenase/delta 5-->4-isomerase type II 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
3BHS5_RAT P27364 CHEMBL4490 3-beta-hydroxysteroid dehydrogenase type III 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT1A_MOUSE Q64264 CHEMBL3737 Serotonin 1a (5-HT1a) receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT1E_HUMAN P28566 CHEMBL2182 Serotonin 1e (5-HT1e) 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_MOUSE Q02152 CHEMBL2583 Serotonin 2b (5-HT2b) receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT3A_MOUSE P23979 CHEMBL4972 Serotonin 3a (5-HT3a) receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT3B_HUMAN O95264 CHEMBL3895 Serotonin 3b (5-HT3b) receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT3B_MOUSE Q9JHJ5 CHEMBL3781 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
5HT4R_CAVPO O70528 CHEMBL5017 Serotonin 4 (5-HT4) receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT5A_MOUSE P30966 CHEMBL3597 Serotonin 5a (5-HT5a) receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
5NTD_RAT P21588 CHEMBL1075214 5'-nucleotidase 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
A0ZX81_KLEPN A0ZX81 CHEMBL1255121 Beta-lactamase 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
A2AIR5_MOUSE A2AIR5 CHEMBL2562 Glutamate [NMDA] receptor subunit 3A 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
A3EZI9_9HEPC A3EZI9 CHEMBL4893 Hepatitis C virus NS3 protease/helicase 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
A4KCT8_9ENTR A4KCT8 CHEMBL1075063 Gil1 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
A4ZYU9_ECOLX A4ZYU9 CHEMBL5305 Beta-lactamase ACC-4 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
AA1R_CHICK P49892 CHEMBL2114 Adenosine A1 receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
AA2AR_CAVPO P46616 CHEMBL2605 Adenosine A2a receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACES_MOUSE P21836 CHEMBL3198 Acetylcholinesterase 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_MOUSE O70174 CHEMBL4457 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
ACHB3_HUMAN Q05901 CHEMBL2586 Neuronal acetylcholine receptor protein beta-3 subunit 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACHP_LYMST P58154 CHEMBL6084 Acetylcholine-binding protein 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
ACM2_HUMAN P08172 CHEMBL211 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
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
ADA2A_PIG P18871 CHEMBL2350 Alpha-2a adrenergic receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADRB1_HUMAN P08588 CHEMBL213 Beta-1 adrenergic receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
AK1A1_RAT P51635 CHEMBL3871 Aldehyde reductase 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
AK1CL_MOUSE Q91WR5 CHEMBL1075270 Aldo-keto reductase family 1 member C21 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ALDH2_HUMAN P05091 CHEMBL1935 Aldehyde dehydrogenase 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ALDR_BOVIN P16116 CHEMBL3081 Aldose reductase 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
AMPC_CITFR P05193 CHEMBL1255130 Beta-lactamase 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
AMPC_MORMO P94958 CHEMBL5764 Beta-lactamase 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
AMPC_PSEAE P24735 CHEMBL5031 Beta-lactamase 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
AMPH_ECOLI P0AD70 CHEMBL4413 Penicillin-binding protein ampH 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ANDR_MOUSE P19091 CHEMBL3056 Androgen Receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ANDR_RAT P15207 CHEMBL3072 Androgen Receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
AOFA_BOVIN P21398 CHEMBL3254 Monoamine oxidase A 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
AROQ_HELPY Q48255 CHEMBL4680 3-dehydroquinate dehydratase 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
AROQ_STRCO P15474 CHEMBL5276 3-dehydroquinate dehydratase 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
B2CL1_HUMAN Q07817 CHEMBL4625 Apoptosis regulator Bcl-X 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
BLA1_ECOLX P0AD63 CHEMBL5956 Beta-lactamase SHV-1 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
BLA1_KLEPN P0AD64 CHEMBL5094 Beta-lactamase SHV-1 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
C0IX24_9CNID C0IX24 CHEMBL1649055 Carbonic anhydrase 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
C11B1_RAT P15393 CHEMBL4970 Cytochrome P450 11B1 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CA2D1_MOUSE O08532 CHEMBL4676 Voltage-gated calcium channel alpha2/delta subunit 1 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAC1D_RAT P27732 CHEMBL4132 Voltage-gated L-type calcium channel alpha-1D subunit 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAC1E_RAT Q07652 CHEMBL4115 Voltage-gated R-type calcium channel alpha-1E 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
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
CAH2_RAT P27139 CHEMBL4706 Carbonic anhydrase II 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH3_RAT P14141 CHEMBL4997 Carbonic anhydrase III 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH4_BOVIN Q95323 CHEMBL281 Carbonic anhydrase IV 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH4_RAT P48284 CHEMBL2962 Carbonic anhydrase IV 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH5A_MOUSE P23589 CHEMBL2330 Carbonic anhydrase VA 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH5A_RAT P43165 CHEMBL2138 Carbonic anhydrase VA 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH5B_MOUSE Q9QZA0 CHEMBL4634 Carbonic anhydrase VB 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH_METTE P40881 CHEMBL3932 Carbonic anhydrase 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAN_YEAST P53615 CHEMBL5931 Carbonic anhydrase 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CASP1_HUMAN P29466 CHEMBL4801 Caspase-1 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CBR1_HUMAN P16152 CHEMBL5586 Carbonyl reductase [NADPH] 1 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CCR5_MOUSE P51682 CHEMBL3676 C-C chemokine receptor type 5 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CDK1_HUMAN P06493 CHEMBL308 Cyclin-dependent kinase 1 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CHIT_YEAST P29029 CHEMBL1293195 Endochitinase 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CHK1_HUMAN O14757 CHEMBL4630 Serine/threonine-protein kinase Chk1 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CHLE_MOUSE Q03311 CHEMBL2528 Butyrylcholinesterase 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CSK21_RAT P19139 CHEMBL2661 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
CSK2B_RAT P67874 CHEMBL2463 Casein kinase II beta 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
D4A3N4_RAT D4A3N4 CHEMBL2679 Brain adenylate cyclase 1 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
D5HSX5_9GAMM D5HSX5 CHEMBL1697666 Extended-spectrum beta-lactamase PER-6 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
DAPK3_HUMAN O43293 CHEMBL2468 Death-associated protein kinase 3 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
DHB1_HUMAN P14061 CHEMBL3181 Estradiol 17-beta-dehydrogenase 1 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
DHB2_HUMAN P37059 CHEMBL2789 Estradiol 17-beta-dehydrogenase 2 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
DHI2_HUMAN P80365 CHEMBL3746 11-beta-hydroxysteroid dehydrogenase 2 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
DRD1_MOUSE Q61616 CHEMBL3071 Dopamine D1 receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
DYR_ECOLI P0ABQ4 CHEMBL1809 Dihydrofolate reductase 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
ECR_DROME P34021 CHEMBL5676 Ecdysone receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ECR_LUCCU O18531 CHEMBL1250403 Ecdysone receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ERBB2_HUMAN P04626 CHEMBL1824 Receptor protein-tyrosine kinase erbB-2 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ERG1_RAT P52020 CHEMBL4241 Squalene monooxygenase 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ERG2_YEAST P32352 CHEMBL3224 C-8 sterol isomerase 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
EST1_HUMAN P23141 CHEMBL2265 Acyl coenzyme A:cholesterol acyltransferase 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
F16P1_HUMAN P09467 CHEMBL3975 Fructose-1,6-bisphosphatase 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
F16P1_PIG P00636 CHEMBL2263 Fructose-1,6-bisphosphatase 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
FAAH1_RAT P97612 CHEMBL3229 Anandamide amidohydrolase 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
FABPL_RAT P02692 CHEMBL5738 Fatty acid-binding protein, liver 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
FGFR1_HUMAN P11362 CHEMBL3650 Fibroblast growth factor receptor 1 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
FGR_RAT Q6P6U0 CHEMBL4362 Tyrosine-protein kinase FGR 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
FOLR1_HUMAN P15328 CHEMBL2121 Folate receptor alpha 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
FOLR2_HUMAN P14207 CHEMBL5064 Folate receptor beta 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
FOLR3_HUMAN P41439 CHEMBL3885 Folate receptor gamma 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
FPPS_HUMAN P14324 CHEMBL1782 Farnesyl diphosphate synthase 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
FYN_HUMAN P06241 CHEMBL1841 Tyrosine-protein kinase FYN 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
GABR1_HUMAN Q9UBS5 CHEMBL2064 GABA-B receptor 1 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
GABR2_HUMAN O75899 CHEMBL5034 GABA-B receptor 2 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
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_HUMAN P48169 CHEMBL2472 GABA receptor alpha-4 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_HUMAN P31644 CHEMBL5112 GABA receptor alpha-5 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_HUMAN Q16445 CHEMBL2579 GABA receptor alpha-6 subunit 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
GBRA6_RAT P30191 CHEMBL293 GABA receptor alpha-6 subunit 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
GBRB1_HUMAN P18505 CHEMBL4558 GABA receptor beta-1 subunit 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
GBRB1_RAT P15431 CHEMBL334 GABA receptor beta-1 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
GBRD_HUMAN O14764 CHEMBL3591 GABA receptor delta subunit 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
GBRD_RAT P18506 CHEMBL337 GABA receptor delta subunit 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
GBRE_HUMAN P78334 CHEMBL4635 GABA receptor epsilon subunit 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
GBRE_RAT Q9ES14 CHEMBL306 GABA receptor epsilon subunit 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
GBRG1_HUMAN Q8N1C3 CHEMBL4044 GABA receptor gamma-1 subunit 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
GBRG3_HUMAN Q99928 CHEMBL2739 GABA receptor gamma-3 subunit 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
GBRG3_RAT P28473 CHEMBL336 GABA receptor gamma-3 subunit 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
GBRP_HUMAN O00591 CHEMBL3506 GABA receptor pi subunit 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
GBRP_RAT O09028 CHEMBL294 GABA receptor pi subunit 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
GBRT_HUMAN Q9UN88 CHEMBL2843 GABA receptor theta subunit 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
GLRA1_HUMAN P23415 CHEMBL5845 Glycine receptor subunit alpha-1 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
GLRA2_HUMAN P23416 CHEMBL5871 Glycine receptor subunit alpha-2 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
GSK3A_HUMAN P49840 CHEMBL2850 Glycogen synthase kinase-3 alpha 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
GSTK1_HUMAN Q9Y2Q3 CHEMBL4491 Glutathione S-transferase kappa 1 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
GUAD_HUMAN Q9Y2T3 CHEMBL3129 Guanine deaminase 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
GYRB_STRPN P0A4L9 CHEMBL1075021 DNA gyrase subunit B 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
IL5_MOUSE P04401 CHEMBL1163111 Interleukin-5 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
KAPCA_HUMAN P17612 CHEMBL4101 cAMP-dependent protein kinase alpha-catalytic subunit 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
KAPCB_HUMAN P22694 CHEMBL2918 cAMP-dependent protein kinase beta-1 catalytic subunit 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
KAPCG_HUMAN P22612 CHEMBL2743 cAMP-dependent protein kinase, gamma catalytic subunit 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
KIT_HUMAN P10721 CHEMBL1936 Stem cell growth factor receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
KPCE_HUMAN Q02156 CHEMBL3582 Protein kinase C epsilon 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
KSYK_RAT Q64725 CHEMBL4364 Tyrosine-protein kinase SYK 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
LGUL_HUMAN Q04760 CHEMBL2424 Glyoxalase I 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
LIPS_RAT P15304 CHEMBL5582 Hormone-sensitive lipase 1 Annotations Catalogs SMILES