UCSF

StruChem BB make-on-demand

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

Binding 10μM Targets with Highest Number of Available Compounds (775 in total)

Name (Uniprot) Swissprot ChEMBL Description Size Browse Download (Annotations)
KCNH2_HUMAN Q12809 CHEMBL240 HERG 16 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT1A_RAT P19327 CHEMBL273 Serotonin 1a (5-HT1a) receptor 15 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT2A_RAT P14842 CHEMBL322 Serotonin 2a (5-HT2a) receptor 15 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADA2A_RAT P22909 CHEMBL327 Alpha-2a adrenergic receptor 13 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADA2B_RAT P19328 CHEMBL266 Alpha-2b adrenergic receptor 13 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADA2C_RAT P22086 CHEMBL314 Alpha-2c adrenergic receptor 13 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADRB2_HUMAN P07550 CHEMBL210 Beta-2 adrenergic receptor 13 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT1B_RAT P28564 CHEMBL3459 Serotonin 1b (5-HT1b) receptor 12 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT1D_RAT P28565 CHEMBL5450 Serotonin 1d (5-HT1d) receptor 12 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH2_HUMAN P00918 CHEMBL205 Carbonic anhydrase II 12 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z104304 Z104304 CHEMBL1907610 Adrenergic receptor alpha-1 12 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT1F_RAT P30940 CHEMBL4646 Serotonin 1f (5-HT1f) receptor 11 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT2B_RAT P30994 CHEMBL323 Serotonin 2b (5-HT2b) receptor 11 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT2C_RAT P08909 CHEMBL324 Serotonin 2c (5-HT2c) receptor 11 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT3A_HUMAN P46098 CHEMBL1899 Serotonin 3a (5-HT3a) receptor 11 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT3B_HUMAN O95264 CHEMBL3895 Serotonin 3b (5-HT3b) receptor 10 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT3C_HUMAN Q8WXA8 CHEMBL4795 Serotonin 3c (5-HT3c) receptor 10 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT3D_HUMAN Q70Z44 CHEMBL4673 Serotonin 3d (5-HT3d) receptor 10 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT3E_HUMAN A5X5Y0 CHEMBL3812 Serotonin 3e (5-HT3e) receptor 10 Annotations Catalogs SMILES SDF Mol2 Flexibase
CA2D1_MOUSE O08532 CHEMBL4676 Voltage-gated calcium channel alpha2/delta subunit 1 10 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z104301 Z104301 CHEMBL1907607 GABA-A receptor; anion channel 10 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADRB1_HUMAN P08588 CHEMBL213 Beta-1 adrenergic receptor 9 Annotations Catalogs SMILES SDF Mol2 Flexibase
SCN1A_HUMAN P35498 CHEMBL1845 Sodium channel protein type I alpha subunit 9 Annotations Catalogs SMILES SDF Mol2 Flexibase
SCN2A_HUMAN Q99250 CHEMBL4187 Sodium channel protein type II alpha subunit 9 Annotations Catalogs SMILES SDF Mol2 Flexibase
SCN3A_HUMAN Q9NY46 CHEMBL5163 Sodium channel protein type III alpha subunit 9 Annotations Catalogs SMILES SDF Mol2 Flexibase
SCN8A_HUMAN Q9UQD0 CHEMBL5202 Sodium channel protein type VIII alpha subunit 9 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT1A_HUMAN P08908 CHEMBL214 Serotonin 1a (5-HT1a) receptor 8 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT2A_HUMAN P28223 CHEMBL224 Serotonin 2a (5-HT2a) receptor 8 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT2C_HUMAN P28335 CHEMBL225 Serotonin 2c (5-HT2c) receptor 8 Annotations Catalogs SMILES SDF Mol2 Flexibase
SC6A4_RAT P31652 CHEMBL313 Serotonin transporter 8 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z104302 Z104302 CHEMBL1907608 Glutamate NMDA receptor 8 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT6R_HUMAN P50406 CHEMBL3371 Serotonin 6 (5-HT6) receptor 7 Annotations Catalogs SMILES SDF Mol2 Flexibase
AOFA_RAT P21396 CHEMBL3358 Monoamine oxidase A 7 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH9_HUMAN Q16790 CHEMBL3594 Carbonic anhydrase IX 7 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT1B_HUMAN P28222 CHEMBL1898 Serotonin 1b (5-HT1b) receptor 6 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT1D_HUMAN P28221 CHEMBL1983 Serotonin 1d (5-HT1d) receptor 6 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADA1A_RAT P43140 CHEMBL319 Alpha-1a adrenergic receptor 6 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH12_HUMAN O43570 CHEMBL3242 Carbonic anhydrase XII 6 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH4_HUMAN P22748 CHEMBL3729 Carbonic anhydrase IV 6 Annotations Catalogs SMILES SDF Mol2 Flexibase
DYR_MOUSE P00375 CHEMBL4564 Dihydrofolate reductase 6 Annotations Catalogs SMILES SDF Mol2 Flexibase
EGFR_HUMAN P00533 CHEMBL203 Epidermal growth factor receptor erbB1 6 Annotations Catalogs SMILES SDF Mol2 Flexibase
HRH1_HUMAN P35367 CHEMBL231 Histamine H1 receptor 6 Annotations Catalogs SMILES SDF Mol2 Flexibase
PGH1_HUMAN P23219 CHEMBL221 Cyclooxygenase-1 6 Annotations Catalogs SMILES SDF Mol2 Flexibase
PNMT_BOVIN P10938 CHEMBL2331 Phenylethanolamine N-methyltransferase 6 Annotations Catalogs SMILES SDF Mol2 Flexibase
SC6A2_HUMAN P23975 CHEMBL222 Norepinephrine transporter 6 Annotations Catalogs SMILES SDF Mol2 Flexibase
SC6A3_HUMAN Q01959 CHEMBL238 Dopamine transporter 6 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACES_HUMAN P22303 CHEMBL220 Acetylcholinesterase 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACM1_HUMAN P11229 CHEMBL216 Muscarinic acetylcholine receptor M1 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
ADA2A_HUMAN P08913 CHEMBL1867 Alpha-2a adrenergic receptor 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADA2C_HUMAN P18825 CHEMBL1916 Alpha-2c adrenergic receptor 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH1_HUMAN P00915 CHEMBL261 Carbonic anhydrase I 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH6_HUMAN P23280 CHEMBL3025 Carbonic anhydrase VI 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
GSK3B_HUMAN P49841 CHEMBL262 Glycogen synthase kinase-3 beta 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
NOS1_HUMAN P29475 CHEMBL3568 Nitric-oxide synthase, brain 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
NOS1_RAT P29476 CHEMBL3048 Nitric-oxide synthase, brain 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
PGH1_SHEEP P05979 CHEMBL2949 Cyclooxygenase-1 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
PGH2_HUMAN P35354 CHEMBL230 Cyclooxygenase-2 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
PGH2_SHEEP P79208 CHEMBL4102 Cyclooxygenase-2 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
Q5AJ71_CANAL Q5AJ71 CHEMBL5337 Carbonic anhydrase 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
5HT7R_HUMAN P34969 CHEMBL3155 Serotonin 7 (5-HT7) 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
AA2AR_RAT P30543 CHEMBL302 Adenosine A2a receptor 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
AA3R_HUMAN P33765 CHEMBL256 Adenosine A3 receptor 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADA2B_HUMAN P18089 CHEMBL1942 Alpha-2b adrenergic receptor 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADRB1_RAT P18090 CHEMBL3252 Beta-1 adrenergic receptor 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADRB3_RAT P26255 CHEMBL4031 Beta-3 adrenergic receptor 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
ALDR_HUMAN P15121 CHEMBL1900 Aldose reductase 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
AOFB_HUMAN P27338 CHEMBL2039 Monoamine oxidase B 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH14_HUMAN Q9ULX7 CHEMBL3510 Carbonic anhydrase XIV 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH7_HUMAN P43166 CHEMBL2326 Carbonic anhydrase VII 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
CHLE_HORSE P81908 CHEMBL5763 Cholinesterase 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
CP19A_HUMAN P11511 CHEMBL1978 Cytochrome P450 19A1 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
DRD2_RAT P61169 CHEMBL339 Dopamine D2 receptor 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
HRH1_RAT P31390 CHEMBL4701 Histamine H1 receptor 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
MK14_HUMAN Q16539 CHEMBL260 MAP kinase p38 alpha 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
NISCH_HUMAN Q9Y2I1 CHEMBL3923 Nischarin 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
NOS2_HUMAN P35228 CHEMBL4481 Nitric oxide synthase, inducible 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
PDE4A_HUMAN P27815 CHEMBL254 Phosphodiesterase 4A 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
PDE4B_HUMAN Q07343 CHEMBL275 Phosphodiesterase 4B 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
PDE4C_HUMAN Q08493 CHEMBL291 Phosphodiesterase 4C 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
PDE4D_HUMAN Q08499 CHEMBL288 Phosphodiesterase 4D 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
PRIO_HUMAN P04156 CHEMBL4869 Prion protein 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
Q9WTR4_RAT Q9WTR4 CHEMBL304 Norepinephrine transporter 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
S5A1_RAT P24008 CHEMBL3422 Steroid 5-alpha-reductase 1 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
S5A2_RAT P31214 CHEMBL5099 Steroid 5-alpha-reductase 2 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
SAHH_HUMAN P23526 CHEMBL2664 Adenosylhomocysteinase 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50597 Z50597 CHEMBL376 Rattus norvegicus 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT1E_HUMAN P28566 CHEMBL2182 Serotonin 1e (5-HT1e) receptor 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT3A_RAT P35563 CHEMBL2411 Serotonin 3a (5-HT3a) receptor 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT3B_RAT Q9JJ16 CHEMBL3458 Serotonin 3b (5-HT3b) receptor 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT4R_HUMAN Q13639 CHEMBL1875 Serotonin 4 (5-HT4) receptor 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
AA1R_RAT P25099 CHEMBL318 Adenosine A1 receptor 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACHA4_RAT P09483 CHEMBL307 Neuronal acetylcholine receptor protein alpha-4 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
ACHB2_RAT P12390 CHEMBL3001 Neuronal acetylcholine receptor protein beta-2 subunit 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADRB2_BOVIN Q28044 CHEMBL3373 Beta-2 adrenergic receptor 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
AOFB_RAT P19643 CHEMBL2993 Monoamine oxidase B 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
B5SU02_9CNID B5SU02 CHEMBL1075028 Alpha carbonic anhydrase 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
C0IX24_9CNID C0IX24 CHEMBL1649055 Carbonic anhydrase 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH13_MOUSE Q9D6N1 CHEMBL2186 Carbonic anhydrase XIII 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH3_HUMAN P07451 CHEMBL2885 Carbonic anhydrase III 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH4_BOVIN Q95323 CHEMBL281 Carbonic anhydrase IV 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH5A_HUMAN P35218 CHEMBL4789 Carbonic anhydrase VA 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
CHLE_HUMAN P06276 CHEMBL1914 Butyrylcholinesterase 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
CTRO_HUMAN O14578 CHEMBL5579 Citron Rho-interacting kinase 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
DDR1_HUMAN Q08345 CHEMBL5319 Epithelial discoidin domain-containing receptor 1 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
DRD3_HUMAN P35462 CHEMBL234 Dopamine D3 receptor 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
DRD4_HUMAN P21917 CHEMBL219 Dopamine D4 receptor 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
DRTS_TOXGO Q07422 CHEMBL2425 Dihydrofolate reductase 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
DYR_HUMAN P00374 CHEMBL202 Dihydrofolate reductase 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
EPHA6_HUMAN Q9UF33 CHEMBL4526 Ephrin type-A receptor 6 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
FABPL_RAT P02692 CHEMBL5738 Fatty acid-binding protein, liver 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
FRK_HUMAN P42685 CHEMBL4223 Tyrosine-protein kinase FRK 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
GAK_HUMAN O14976 CHEMBL4355 Serine/threonine-protein kinase GAK 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
I23O1_HUMAN P14902 CHEMBL4685 Indoleamine 2,3-dioxygenase 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
KC1AL_HUMAN Q8N752 CHEMBL5520 Casein kinase I isoform alpha-like 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
KC1D_HUMAN P48730 CHEMBL2828 Casein kinase I delta 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
KC1E_HUMAN P49674 CHEMBL4937 Casein kinase I epsilon 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
KS6A1_HUMAN Q15418 CHEMBL2553 Ribosomal protein S6 kinase alpha 1 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
KS6A6_HUMAN Q9UK32 CHEMBL4924 Ribosomal protein S6 kinase alpha 6 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
LCK_HUMAN P06239 CHEMBL258 Tyrosine-protein kinase LCK 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
MP2K2_HUMAN P36507 CHEMBL2964 Dual specificity mitogen-activated protein kinase kinase 2 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
NMDZ1_RAT P35439 CHEMBL330 Glutamate (NMDA) receptor subunit zeta 1 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
O77823_PIG O77823 CHEMBL3333 Phosphodiesterase 4A 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
PDE1A_BOVIN P14100 CHEMBL3774 Phosphodiesterase 1A 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
PDE3A_HUMAN Q14432 CHEMBL241 Phosphodiesterase 3A 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
PDE3B_HUMAN Q13370 CHEMBL290 Phosphodiesterase 3B 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
PDE4A_RAT P54748 CHEMBL4964 Phosphodiesterase 4A 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
PDE4B_RAT P14646 CHEMBL3382 Phosphodiesterase 4B 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
PDE4C_RAT P14644 CHEMBL4562 Phosphodiesterase 4C 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
PDE4D_RAT P14270 CHEMBL2712 Phosphodiesterase 4D 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
PGH1_BOVIN O62664 CHEMBL2860 Cyclooxygenase-1 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
PGH2_MOUSE Q05769 CHEMBL4321 Cyclooxygenase-2 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
Q63380_RAT Q63380 CHEMBL6184 Transporter 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
Q72874_9HIV1 Q72874 CHEMBL243 Human immunodeficiency virus type 1 protease 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
Q864F1_PIG Q864F1 CHEMBL3634 Phosphodiesterase 5 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
SC6A1_RAT P23978 CHEMBL4054 GABA transporter 1 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
SLK_HUMAN Q9H2G2 CHEMBL4202 Serine/threonine-protein kinase 2 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
SRC_HUMAN P12931 CHEMBL267 Tyrosine-protein kinase SRC 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
TNIK_HUMAN Q9UKE5 CHEMBL4527 TRAF2- and NCK-interacting kinase 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
TRY1_HUMAN P07477 CHEMBL209 Trypsin I 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
TTK_HUMAN P33981 CHEMBL3983 Dual specificity protein kinase TTK 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
TYSY_ECOLI P0A884 CHEMBL2555 Thymidylate synthase 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
TYSY_HUMAN P04818 CHEMBL1952 Thymidylate synthase 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
Y1284_MYCTU P64797 CHEMBL5631 Uncharacterized protein Rv1284/MT1322 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT1D_PIG P79400 CHEMBL4105 Serotonin 1d (5-HT1d) receptor 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT2B_HUMAN P41595 CHEMBL1833 Serotonin 2b (5-HT2b) receptor 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
5NTD_RAT P21588 CHEMBL1075214 5'-nucleotidase 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
AA2BR_RAT P29276 CHEMBL2592 Adenosine A2b receptor 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ABCG2_HUMAN Q9UNQ0 CHEMBL5393 ATP-binding cassette sub-family G member 2 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACES_BOVIN P23795 CHEMBL4768 Acetylcholinesterase 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACES_ELEEL O42275 CHEMBL4078 Acetylcholinesterase 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACES_RAT P37136 CHEMBL3199 Acetylcholinesterase 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACH10_RAT Q9JLB5 CHEMBL3461 Neuronal acetylcholine receptor protein alpha-10 subunit 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_RAT P04757 CHEMBL3818 Neuronal acetylcholine receptor protein alpha-3 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_HUMAN P36544 CHEMBL2492 Neuronal acetylcholine receptor protein alpha-7 subunit 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACHA_RAT P25108 CHEMBL3599 Acetylcholine receptor protein alpha chain 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
ACM1_RAT P08482 CHEMBL276 Muscarinic acetylcholine receptor M1 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACM2_HUMAN P08172 CHEMBL211 Muscarinic acetylcholine receptor M2 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
ACV1B_HUMAN P36896 CHEMBL5310 Activin receptor type-1B 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADA1B_RAT P15823 CHEMBL315 Alpha-1b adrenergic receptor 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADA1D_RAT P23944 CHEMBL326 Alpha-1d adrenergic receptor 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADCK4_HUMAN Q96D53 CHEMBL5753 Uncharacterized aarF domain-containing protein kinase 4 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADRB1_BOVIN Q9TT96 CHEMBL2313 Beta-1 adrenergic receptor 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADRB2_CANFA P54833 CHEMBL2289 Beta-2 adrenergic receptor 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADRB2_CAVPO Q8K4Z4 CHEMBL5414 Beta-2 adrenergic receptor 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADRB3_BOVIN P46626 CHEMBL3083 Beta-3 adrenergic receptor 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADRB3_HUMAN P13945 CHEMBL246 Beta-3 adrenergic receptor 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
AK1C3_HUMAN P42330 CHEMBL4681 Aldo-keto-reductase family 1 member C3 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ALDR_PIG P80276 CHEMBL4559 Aldose reductase 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ALDR_RAT P07943 CHEMBL2622 Aldose reductase 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
AMPN_HUMAN P15144 CHEMBL1907 Aminopeptidase N 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ANDR_HUMAN P10275 CHEMBL1871 Androgen Receptor 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
AOFA_HUMAN P21397 CHEMBL1951 Monoamine oxidase A 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
B0BL08_ECOLX B0BL08 CHEMBL5441 Dihydrofolate reductase 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
BRAF_HUMAN P15056 CHEMBL5145 Serine/threonine-protein kinase B-raf 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH15_MOUSE Q99N23 CHEMBL5973 Carbonic anhydrase 15 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH5A_MOUSE P23589 CHEMBL2330 Carbonic anhydrase VA 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH5B_HUMAN Q9Y2D0 CHEMBL3969 Carbonic anhydrase VB 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH5B_MOUSE Q9QZA0 CHEMBL4634 Carbonic anhydrase VB 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH_METTE P40881 CHEMBL3932 Carbonic anhydrase 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAN_YEAST P53615 CHEMBL5931 Carbonic anhydrase 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
CATK_HUMAN P43235 CHEMBL268 Cathepsin K 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
CHK1_HUMAN O14757 CHEMBL4630 Serine/threonine-protein kinase Chk1 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
CP1B1_HUMAN Q16678 CHEMBL4878 Cytochrome P450 1B1 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
CP2J2_HUMAN P51589 CHEMBL3491 Cytochrome P450 2J2 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
CSK21_HUMAN P68400 CHEMBL3629 Casein kinase II alpha 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
CYNT_MYCTU O53573 CHEMBL6068 Carbonic anhydrase 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
DDR2_HUMAN Q16832 CHEMBL5122 Discoidin domain-containing receptor 2 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
DHB3_HUMAN P37058 CHEMBL4234 Estradiol 17-beta-dehydrogenase 3 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
DRD1_HUMAN P21728 CHEMBL2056 Dopamine D1 receptor 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
DRD2_HUMAN P14416 CHEMBL217 Dopamine D2 receptor 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
DYR1_ECOLX P00382 CHEMBL2627 Dihydrofolate reductase type 1 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
DYR_ECOLI P0ABQ4 CHEMBL1809 Dihydrofolate reductase 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
DYR_LACCA P00381 CHEMBL2902 Dihydrofolate reductase 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
DYR_PNECA P16184 CHEMBL1926 Dihydrofolate reductase 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
E1BN64_BOVIN E1BN64 CHEMBL5129 Phosphodiesterase 3B 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
FGFR1_HUMAN P11362 CHEMBL3650 Fibroblast growth factor receptor 1 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
FGFR2_HUMAN P21802 CHEMBL4142 Fibroblast growth factor receptor 2 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
FGFR3_HUMAN P22607 CHEMBL2742 Fibroblast growth factor receptor 3 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
FYN_HUMAN P06241 CHEMBL1841 Tyrosine-protein kinase FYN 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
GABR1_RAT Q9Z0U4 CHEMBL2753 GABA-B receptor 1 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
GABR2_RAT O88871 CHEMBL4686 GABA-B receptor 2 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
GBRB1_RAT P15431 CHEMBL334 GABA receptor beta-1 subunit 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
GBRB2_RAT P63138 CHEMBL295 GABA receptor beta-2 subunit 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
GBRB3_RAT P63079 CHEMBL316 GABA receptor beta-3 subunit 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
HCAR2_HUMAN Q8TDS4 CHEMBL3785 Nicotinic acid receptor 1 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
HRH3_RAT Q9QYN8 CHEMBL4124 Histamine H3 receptor 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
HRP1_PLAFA P05227 CHEMBL1923 Histidine-rich protein 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
KAP2_BOVIN P00515 CHEMBL3654 cAMP-dependent protein kinase type II-alpha regulatory subunit 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
KAPCA_HUMAN P17612 CHEMBL4101 cAMP-dependent protein kinase alpha-catalytic subunit 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
KAPCA_MOUSE P05132 CHEMBL4991 cAMP-dependent protein kinase alpha-catalytic subunit 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
KAPCB_HUMAN P22694 CHEMBL2918 cAMP-dependent protein kinase beta-1 catalytic subunit 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
KAPCB_MOUSE P68181 CHEMBL2481 cAMP-dependent protein kinase beta-1 catalytic subunit 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
KS6A5_HUMAN O75582 CHEMBL4237 Ribosomal protein S6 kinase alpha 5 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
LATS2_HUMAN Q9NRM7 CHEMBL5907 Serine/threonine-protein kinase LATS2 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
LKHA4_HUMAN P09960 CHEMBL4618 Leukotriene A4 hydrolase 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
M4K4_HUMAN O95819 CHEMBL6166 Mitogen-activated protein kinase kinase kinase kinase 4 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
MK08_HUMAN P45983 CHEMBL2276 c-Jun N-terminal kinase 1 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
MK09_HUMAN P45984 CHEMBL4179 c-Jun N-terminal kinase 2 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
MK10_HUMAN P53779 CHEMBL2637 c-Jun N-terminal kinase 3 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
MK11_HUMAN Q15759 CHEMBL3961 MAP kinase p38 beta 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
MK12_HUMAN P53778 CHEMBL4674 MAP kinase p38 gamma 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
MK13_HUMAN O15264 CHEMBL2939 MAP kinase p38 delta 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
MMP2_HUMAN P08253 CHEMBL333 Matrix metalloproteinase-2 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
MPIP2_HUMAN P30305 CHEMBL4804 Dual specificity phosphatase Cdc25B 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
MRCKB_HUMAN Q9Y5S2 CHEMBL5052 Serine/threonine-protein kinase MRCK beta 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
MRCKG_HUMAN Q6DT37 CHEMBL5615 Serine/threonine-protein kinase MRCK gamma 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
MRP1_HUMAN P33527 CHEMBL3004 Multidrug resistance-associated protein 1 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
MYLK_HUMAN Q15746 CHEMBL2428 Myosin light chain kinase, smooth muscle 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
NLK_HUMAN Q9UBE8 CHEMBL5364 Serine/threonine protein kinase NLK 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
NOS2_MOUSE P29477 CHEMBL3464 Nitric oxide synthase, inducible 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
NOS3_HUMAN P29474 CHEMBL4803 Nitric-oxide synthase, endothelial 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
NQO2_HUMAN P16083 CHEMBL3959 Quinone reductase 2 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
OXDA_HUMAN P14920 CHEMBL5485 D-amino-acid oxidase 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
P96878_MYCTU P96878 CHEMBL5767 PROBABLE TRANSMEMBRANE CARBONIC ANHYDRASE (CARBONATE DEHYDRATASE) (CARBONIC DEHYDRATASE) 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
PCP_HUMAN P42785 CHEMBL2335 Lysosomal Pro-X carboxypeptidase 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
PDE4A_MOUSE O89084 CHEMBL2698 Phosphodiesterase 4A 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
PDE4C_MOUSE Q3UEI1 CHEMBL2550 Phosphodiesterase 4C 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
PDE4D_MOUSE Q01063 CHEMBL3846 Phosphodiesterase 4D 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
PERM_HUMAN P05164 CHEMBL2439 Myeloperoxidase 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
PIM1_HUMAN P11309 CHEMBL2147 Serine/threonine-protein kinase PIM1 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
PKN1_HUMAN Q16512 CHEMBL3384 Protein kinase N1 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
PKN2_HUMAN Q16513 CHEMBL3032 Protein kinase N2 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
PNMT_HUMAN P11086 CHEMBL4617 Phenylethanolamine N-methyltransferase 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
PPARA_HUMAN Q07869 CHEMBL239 Peroxisome proliferator-activated receptor alpha 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
PPARG_HUMAN P37231 CHEMBL235 Peroxisome proliferator-activated receptor gamma 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
PPARG_MOUSE P37238 CHEMBL2459 Peroxisome proliferator-activated receptor gamma 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
PPARG_RAT O88275 CHEMBL4797 Peroxisome proliferator-activated receptor gamma 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
PTK6_HUMAN Q13882 CHEMBL4601 Tyrosine-protein kinase BRK 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
PTR1_LEIMA Q01782 CHEMBL6194 Pteridine reductase 1 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Q3I4V7_CRYNV Q3I4V7 CHEMBL1697676 Carbonic anhydrase 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
Q7ZJM1_9HIV1 Q7ZJM1 CHEMBL3471 Human immunodeficiency virus type 1 integrase 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Q8SPQ9_CANFA Q8SPQ9 CHEMBL4033 Cyclooxygenase-2 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Q8VBU5_MOUSE Q8VBU5 CHEMBL2272 Phosphodiesterase 4B 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Q965D5_PLAFA Q965D5 CHEMBL4150 Enoyl-acyl-carrier protein reductase 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
RAF1_HUMAN P04049 CHEMBL1906 Serine/threonine-protein kinase RAF 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
RIPK2_HUMAN O43353 CHEMBL5014 Serine/threonine-protein kinase RIPK2 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ROCK1_HUMAN Q13464 CHEMBL3231 Rho-associated protein kinase 1 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ROCK2_HUMAN O75116 CHEMBL2973 Rho-associated protein kinase 2 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
S6A11_RAT P31647 CHEMBL3598 GABA transporter 3 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
S6A12_RAT P48056 CHEMBL5248 Betaine transporter 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
S6A13_RAT P31646 CHEMBL4889 GABA transporter 2 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ST32B_HUMAN Q9NY57 CHEMBL5912 Serine/threonine-protein kinase 32B 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
STK36_HUMAN Q9NRP7 CHEMBL4312 Serine/threonine-protein kinase 36 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
THRB_HUMAN P00734 CHEMBL204 Thrombin 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
TYSY_MOUSE P07607 CHEMBL3160 Thymidylate synthase 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
XDH_HUMAN P47989 CHEMBL1929 Xanthine dehydrogenase 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z100081 Z100081 CHEMBL613107 PBMC (Peripheral blood mononuclear cells) 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z100275 Z100275 CHEMBL613898 Hemozoin 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z104283 Z104283 CHEMBL1907589 Neuronal acetylcholine receptor; alpha4/beta2 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z104303 Z104303 CHEMBL1907609 Muscarinic acetylcholine receptor 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
5HT1F_HUMAN P30939 CHEMBL1805 Serotonin 1f (5-HT1f) receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT4R_RAT Q62758 CHEMBL4317 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
5HT5A_RAT P35364 CHEMBL4655 Serotonin 5a (5-HT5a) receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT5B_RAT P35365 CHEMBL2619 Serotonin 5b (5-HT5b) receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT6R_RAT P31388 CHEMBL3372 Serotonin 6 (5-HT6) receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT7R_RAT P32305 CHEMBL3223 Serotonin 7 (5-HT7) receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
A3RLP8_CHV1 A3RLP8 CHEMBL1075062 Thymidine kinase 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
AAK1_HUMAN Q2M2I8 CHEMBL3830 Adaptor-associated kinase 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
AAPK1_HUMAN Q13131 CHEMBL4045 AMP-activated protein kinase, alpha-1 subunit 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
AAPK2_HUMAN P54646 CHEMBL2116 AMP-activated protein kinase, alpha-2 subunit 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ABL1_HUMAN P00519 CHEMBL1862 Tyrosine-protein kinase ABL 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ABL2_HUMAN P42684 CHEMBL4014 Tyrosine-protein kinase ABL2 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACE2_HUMAN Q9BYF1 CHEMBL3736 Angiotensin-converting enzyme 2 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACES_TORCA P04058 CHEMBL4780 Acetylcholinesterase 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACE_HUMAN P12821 CHEMBL1808 Angiotensin-converting enzyme 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACE_RABIT P12822 CHEMBL4074 Angiotensin-converting enzyme 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACE_RAT P47820 CHEMBL2625 Angiotensin-converting enzyme 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_CHICK P09482 CHEMBL5569 Neuronal acetylcholine receptor subunit alpha-4 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
ACHB2_HUMAN P17787 CHEMBL1883 Neuronal acetylcholine receptor protein beta-2 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
ACHB4_HUMAN P30926 CHEMBL3002 Neuronal acetylcholine receptor protein beta-4 subunit 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACHD_TORCA P02718 CHEMBL3916 Acetylcholine receptor protein delta chain 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACK1_HUMAN Q07912 CHEMBL4599 Tyrosine kinase non-receptor protein 2 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADCY1_HUMAN Q08828 CHEMBL2899 Brain adenylate cyclase 1 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADCY2_HUMAN Q08462 CHEMBL3760 Adenylate cyclase type II 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADCY8_HUMAN P40145 CHEMBL2960 Adenylate cyclase type VIII 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADRB2_RAT P10608 CHEMBL3754 Beta-2 adrenergic receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
AHK3_ARATH Q9C5U1 CHEMBL6125 Histidine kinase 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
AHK4_ARATH Q9C5U0 CHEMBL6124 Histidine kinase 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
AK1A1_RAT P51635 CHEMBL3871 Aldehyde reductase 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
AK1C1_HUMAN Q04828 CHEMBL5905 Aldo-keto reductase family 1 member C1 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
AK1C2_HUMAN P52895 CHEMBL5847 Aldo-keto reductase family 1 member C2 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
AKT2_HUMAN P31751 CHEMBL2431 Serine/threonine-protein kinase AKT2 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
AL1A7_RAT P13601 CHEMBL5354 Aldehyde dehydrogenase, cytosolic 1 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ALDR_BOVIN P16116 CHEMBL3081 Aldose reductase 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ALK_HUMAN Q9UM73 CHEMBL4247 ALK tyrosine kinase receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
AMP1_PLAFQ O96935 CHEMBL4117 Zinc aminopeptidase 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
AMPB_HUMAN Q9H4A4 CHEMBL2432 Aminopeptidase B 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
AMPB_MOUSE Q8VCT3 CHEMBL2836 Aminopeptidase B 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
AMPB_RAT O09175 CHEMBL2452 Aminopeptidase B 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
AMPC_ECOLI P00811 CHEMBL2026 Beta-lactamase 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
AMPE_HUMAN Q07075 CHEMBL3439 Aminopeptidase A 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
AMPH_ECOLI P0AD70 CHEMBL4413 Penicillin-binding protein ampH 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
AMPL_BOVIN P00727 CHEMBL1671610 Cytosol aminopeptidase 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
AMPL_HUMAN P28838 CHEMBL3965 Leucine aminopeptidase 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
AMPN_PIG P15145 CHEMBL2590 Aminopeptidase N 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ANDR_RAT P15207 CHEMBL3072 Androgen Receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ANKK1_HUMAN Q8NFD2 CHEMBL5547 Ankyrin repeat and protein kinase domain-containing protein 1 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
AOFA_BOVIN P21398 CHEMBL3254 Monoamine oxidase A 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
AOFB_BOVIN P56560 CHEMBL2756 Monoamine oxidase B 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
AROA_ECOLI P0A6D3 CHEMBL5033 5-enolpyruvylshikimate-3-phosphate synthase 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
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
AVR2B_HUMAN Q13705 CHEMBL5466 Activin receptor type-2B 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
BGLR_RAT P06760 CHEMBL4814 Beta-glucuronidase 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
BLK_HUMAN P51451 CHEMBL2250 Tyrosine-protein kinase BLK 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
BMP2K_HUMAN Q9NSY1 CHEMBL4522 BMP-2-inducible protein kinase 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
BMPR2_HUMAN Q13873 CHEMBL5467 Bone morphogenetic protein receptor type-2 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
BRD4_HUMAN O60885 CHEMBL1163125 Bromodomain-containing protein 4 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
BRSK1_HUMAN Q8TDC3 CHEMBL5650 BR serine/threonine-protein kinase 1 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
BRSK2_HUMAN Q8IWQ3 CHEMBL4574 BR serine/threonine-protein kinase 2 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
C11B1_HUMAN P15538 CHEMBL1908 Cytochrome P450 11B1 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
C11B2_HUMAN P19099 CHEMBL2722 Cytochrome P450 11B2 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CA2D1_RAT P54290 CHEMBL3420 Voltage-gated calcium channel alpha2/delta subunit 1 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAC1B_HUMAN Q00975 CHEMBL4478 Voltage-gated N-type calcium channel alpha-1B subunit 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAC1B_RAT Q02294 CHEMBL5107 Voltage-gated N-type calcium channel alpha-1B subunit 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CACB1_RAT P54283 CHEMBL1075136 Voltage-dependent L-type calcium channel subunit beta-1 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH13_HUMAN Q8N1Q1 CHEMBL3912 Carbonic anhydrase XIII 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CBPA1_BOVIN P00730 CHEMBL3481 Carboxypeptidase A1 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CCL2_HUMAN P13500 CHEMBL1649052 C-C motif chemokine 2 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CDK14_HUMAN O94921 CHEMBL6162 Serine/threonine-protein kinase PFTAIRE-1 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CDK16_HUMAN Q00536 CHEMBL4597 Serine/threonine-protein kinase PCTAIRE-1 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CDK17_HUMAN Q00537 CHEMBL5790 Serine/threonine-protein kinase PCTAIRE-2 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CDK18_HUMAN Q07002 CHEMBL5316 Serine/threonine-protein kinase PCTAIRE-3 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CDK1_HUMAN P06493 CHEMBL308 Cyclin-dependent kinase 1 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CDK7_HUMAN P50613 CHEMBL3055 Cyclin-dependent kinase 7 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CDKL2_HUMAN Q92772 CHEMBL5728 Cyclin-dependent kinase-like 2 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CHK2_HUMAN O96017 CHEMBL2527 Serine/threonine-protein kinase Chk2 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CLK1_HUMAN P49759 CHEMBL4224 Dual specificty protein kinase CLK1 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CLK2_HUMAN P49760 CHEMBL4225 Dual specificity protein kinase CLK2 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CLK4_HUMAN Q9HAZ1 CHEMBL4203 Dual specificity protein kinase CLK4 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CLTR1_HUMAN Q9Y271 CHEMBL1798 Cysteinyl leukotriene receptor 1 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CLTR2_HUMAN Q9NS75 CHEMBL4330 Cysteinyl leukotriene receptor 2 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CNCG_BOVIN P22571 CHEMBL4606 Phosphodiesterase 6H 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CNCG_HUMAN Q13956 CHEMBL2341 Phosphodiesterase 6H 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CNR1_RAT P20272 CHEMBL3571 Cannabinoid CB1 receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CNR2_HUMAN P34972 CHEMBL253 Cannabinoid CB2 receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CNRG_BOVIN P04972 CHEMBL5111 Phosphodiesterase 6G 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CNRG_HUMAN P18545 CHEMBL2415 Phosphodiesterase 6G 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
COX2_SHEEP O78750 CHEMBL1250404 Cytochrome c oxidase subunit 2 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CP19A_RAT P22443 CHEMBL3859 Cytochrome P450 19A1 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CSF1R_HUMAN P07333 CHEMBL1844 Macrophage colony stimulating factor receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CSK22_HUMAN P19784 CHEMBL4070 Casein kinase II alpha (prime) 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CSK2B_HUMAN P67870 CHEMBL2358 Casein kinase II beta 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CTRA_BOVIN P00766 CHEMBL3314 Alpha-chymotrypsin 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CXCR1_HUMAN P25024 CHEMBL4029 Interleukin-8 receptor A 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CYNT_HELPY O24855 CHEMBL4211 Carbonic anhydrase 1 1 Annotations Catalogs SMILES SDF Mol2