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Q9Y5Y9 | SCNAA_HUMAN | Sodium channel protein type 10 subunit alpha (SCN10A)

3D structures mapped by conservation among orthologs



[ Alpha Fold Model ] (go)


Known binders annotated in ChEMBL

IC50 table Ki table

molecule_chembl_id structure assay_type relation values units mol_wt smiles organism assay_chembl_id bao_label
CHEMBL4760292 OBDepict O N H N N Cl CH 3 N S O O NH 2 F F IC50 = 0.3 nM 459.91 Cc1nc(N2CCCC(F)(F)CC2)c(C(=O)Nc2ccnc(S(N)(=O)=O)c2)cc1Cl Homo sapiens CHEMBL4672963 cell-based format
CHEMBL4798938 OBDepict CH 3 O O F F F F N H O O CH 3 F O N F F F O H 2 N IC50 = 0.4 nM 581.37 COc1cc(Oc2ccc(OC(F)(F)F)c(F)c2OC)c(C(=O)Nc2ccnc(C(N)=O)c2)c(F)c1C(F)(F)F Homo sapiens CHEMBL4672974 cell-based format
CHEMBL4777598 OBDepict O N H N N CH 3 F F F N S O O NH 2 F F IC50 = 0.5 nM 493.46 Cc1nc(N2CCCC(F)(F)CC2)c(C(=O)Nc2ccnc(S(N)(=O)=O)c2)cc1C(F)(F)F Homo sapiens CHEMBL4672963 cell-based format
CHEMBL4753280 OBDepict H 3 C O O F O F F F NH O F CH 3 F F F N O H 2 N IC50 = 0.8 nM 565.37 COc1c(Oc2cc(C(F)(F)F)c(C)c(F)c2C(=O)Nc2ccnc(C(N)=O)c2)ccc(OC(F)(F)F)c1F Homo sapiens CHEMBL4672974 cell-based format
CHEMBL4781110 OBDepict O NH N N N S O O NH 2 F F IC50 = 0.9 nM 465.53 NS(=O)(=O)c1cc(NC(=O)c2ccc(CC3CC3)nc2N2CCCC(F)(F)CC2)ccn1 Homo sapiens CHEMBL4672963 cell-based format
CHEMBL4745699 OBDepict O N H N N N S O O H 2 N F F IC50 = 1.0 nM 465.53 NS(=O)(=O)c1cc(NC(=O)c2cc(CC3CC3)cnc2N2CCCC(F)(F)CC2)ccn1 Homo sapiens CHEMBL4672963 cell-based format
CHEMBL1277958 OBDepict CH 3 O N N HN O CH 3 IC50 = 1.0 nM 333.39 CCOc1ccc(-c2cncc(C(=O)Nc3cccc(C)c3)n2)cc1 Homo sapiens CHEMBL1286452 cell-based format
CHEMBL4744908 OBDepict CH 3 O Cl F O N H O O CH 3 F N O O H 2 N F F F IC50 = 1.3 nM 547.82 COc1c(Cl)cc(Oc2ccc(OC(F)(F)F)c(F)c2OC)c(C(=O)Nc2ccnc(C(N)=O)c2)c1F Homo sapiens CHEMBL4672974 cell-based format
CHEMBL4750365 OBDepict H 3 C O O F O F F F Cl NH O F CH 3 N O H 2 N IC50 = 1.4 nM 531.82 COc1c(Oc2cc(Cl)c(C)c(F)c2C(=O)Nc2ccnc(C(N)=O)c2)ccc(OC(F)(F)F)c1F Homo sapiens CHEMBL4672974 cell-based format
CHEMBL4764433 OBDepict O N H N N H 3 C CH 3 N S O O NH 2 F F IC50 = 1.6 nM 439.49 Cc1cc(C(=O)Nc2ccnc(S(N)(=O)=O)c2)c(N2CCCC(F)(F)CC2)nc1C Homo sapiens CHEMBL4672963 cell-based format
CHEMBL4787299 OBDepict CH 3 O F F F F N H O O O N CH 3 F O H 2 N O F F F IC50 = 1.6 nM 581.37 COc1c(Oc2cc(C(F)(F)F)c(OC)c(F)c2C(=O)Nc2ccnc(C(N)=O)c2)ccc(OC(F)(F)F)c1F Homo sapiens CHEMBL4672974 cell-based format
CHEMBL4756380 OBDepict CH 3 O Cl O F N H O O CH 3 F O N F F F O H 2 N IC50 = 1.7 nM 547.82 COc1cc(Oc2ccc(OC(F)(F)F)c(F)c2OC)c(C(=O)Nc2ccnc(C(N)=O)c2)c(F)c1Cl Homo sapiens CHEMBL4672974 cell-based format
CHEMBL4782190 OBDepict CH 3 O O F F F F N H O O CH 3 O N F F F O H 2 N IC50 = 1.8 nM 563.38 COc1cc(OC(F)(F)F)ccc1Oc1cc(OC)c(C(F)(F)F)c(F)c1C(=O)Nc1ccnc(C(N)=O)c1 Homo sapiens CHEMBL4672974 cell-based format
CHEMBL4785523 OBDepict CH 3 O O O F F F NH O Cl F F F N O H 2 N IC50 = 2.0 nM 549.81 COc1cc(OC(F)(F)F)ccc1Oc1ccc(C(F)(F)F)c(Cl)c1C(=O)Nc1ccnc(C(N)=O)c1 Homo sapiens CHEMBL4672974 cell-based format
CHEMBL4483603 OBDepict CH 3 NH 2 H N N H H 3 C CH 3 H 3 C IC50 = 2.0 nM 245.37 CCC[C@H](N)c1nc2cc(C(C)(C)C)ccc2[nH]1 Homo sapiens CHEMBL4331778 cell-based format
CHEMBL1270797 OBDepict CH 3 N H H 3 C O O O F F F IC50 = 2.0 nM 375.35 Cc1cc(C)cc(NC(=O)c2ccc(-c3ccc(OC(F)(F)F)cc3)o2)c1 Homo sapiens CHEMBL1272888 single protein format
CHEMBL4761578 OBDepict CH 3 O O O F F F NH O Br F F F N O H 2 N IC50 = 2.0 nM 594.26 COc1cc(OC(F)(F)F)ccc1Oc1ccc(C(F)(F)F)c(Br)c1C(=O)Nc1ccnc(C(N)=O)c1 Homo sapiens CHEMBL4672974 cell-based format
CHEMBL1269882 OBDepict Cl N N H O CH 3 IC50 = 2.0 nM 336.82 Cc1ccccc1CNC(=O)c1cncc(-c2ccc(Cl)cc2)c1 Homo sapiens CHEMBL1272888 single protein format
CHEMBL1277877 OBDepict CH 3 O N N NH O H 3 C CH 3 IC50 = 2.0 nM 347.42 CCOc1ccc(-c2cncc(C(=O)Nc3cc(C)cc(C)c3)n2)cc1 Homo sapiens CHEMBL1286452 cell-based format
CHEMBL1277959 OBDepict CH 3 O N N NH O CH 3 IC50 = 2.0 nM 347.42 CCOc1ccc(-c2cncc(C(=O)NCc3ccccc3C)n2)cc1 Homo sapiens CHEMBL1286452 cell-based format
CHEMBL4763419 OBDepict H 3 C O O F O F F F NH O F Cl N O H 2 N IC50 = 2.3 nM 517.79 COc1c(Oc2ccc(Cl)c(F)c2C(=O)Nc2ccnc(C(N)=O)c2)ccc(OC(F)(F)F)c1F Homo sapiens CHEMBL4672974 cell-based format
CHEMBL4743638 OBDepict O N H N N Cl N S O O NH 2 F F IC50 = 2.6 nM 499.97 NS(=O)(=O)c1cc(NC(=O)c2cc(Cl)c(C3CCC3)nc2N2CCCC(F)(F)CC2)ccn1 Homo sapiens CHEMBL4672963 cell-based format
CHEMBL4751356 OBDepict O HN N N O N S F F F O O NH 2 F F IC50 = 2.8 nM 495.43 NS(=O)(=O)c1cc(NC(=O)c2cc(OC(F)(F)F)cnc2N2CCCC(F)(F)CC2)ccn1 Homo sapiens CHEMBL4672963 cell-based format
CHEMBL4764805 OBDepict H 3 C O O F O F F F NH O H 3 C F F F N O H 2 N IC50 = 3.0 nM 547.38 COc1c(Oc2ccc(C(F)(F)F)c(C)c2C(=O)Nc2ccnc(C(N)=O)c2)ccc(OC(F)(F)F)c1F Homo sapiens CHEMBL4672974 cell-based format
CHEMBL1270208 OBDepict Cl N N H O N O F F F IC50 = 3.0 nM 421.81 O=C(NCc1cccnc1OCC(F)(F)F)c1cncc(-c2ccc(Cl)cc2)c1 Homo sapiens CHEMBL1272888 single protein format
CHEMBL4748189 OBDepict O N H N N N S O O H 2 N F F IC50 = 3.0 nM 451.5 NS(=O)(=O)c1cc(NC(=O)c2ccc(C3CC3)nc2N2CCCC(F)(F)CC2)ccn1 Homo sapiens CHEMBL4672963 cell-based format
CHEMBL1277514 OBDepict Cl N N N H O H 3 C CH 3 IC50 = 3.0 nM 337.81 Cc1cc(C)cc(NC(=O)c2cncc(-c3ccc(Cl)cc3)n2)c1 Homo sapiens CHEMBL1286452 cell-based format
CHEMBL4778738 OBDepict CH 3 N N N H O F F N S O O NH 2 IC50 = 3.1 nM 425.46 Cc1ccc(C(=O)Nc2ccnc(S(N)(=O)=O)c2)c(N2CCCC(F)(F)CC2)n1 Homo sapiens CHEMBL4672963 cell-based format
CHEMBL4777784 OBDepict Cl N N HN O F F N S O O NH 2 IC50 = 3.9 nM 445.88 NS(=O)(=O)c1cc(NC(=O)c2cc(Cl)cnc2N2CCCC(F)(F)CC2)ccn1 Homo sapiens CHEMBL4672963 cell-based format
CHEMBL1269883 OBDepict Cl N N H O Cl IC50 = 4.0 nM 357.24 O=C(NCc1ccccc1Cl)c1cncc(-c2ccc(Cl)cc2)c1 Homo sapiens CHEMBL1272888 single protein format
CHEMBL4759624 OBDepict CH 3 O O O F F F NH O H 3 C F F F N O H 2 N IC50 = 4.0 nM 529.39 COc1cc(OC(F)(F)F)ccc1Oc1ccc(C(F)(F)F)c(C)c1C(=O)Nc1ccnc(C(N)=O)c1 Homo sapiens CHEMBL4672974 cell-based format
CHEMBL4796719 OBDepict O HN N N F F F N S O O NH 2 F F IC50 = 4.1 nM 479.43 NS(=O)(=O)c1cc(NC(=O)c2cc(C(F)(F)F)cnc2N2CCCC(F)(F)CC2)ccn1 Homo sapiens CHEMBL4672963 cell-based format
CHEMBL4759995 OBDepict O N H N N Cl N S O O H 2 N F F IC50 = 4.5 nM 485.94 NS(=O)(=O)c1cc(NC(=O)c2cc(Cl)c(C3CC3)nc2N2CCCC(F)(F)CC2)ccn1 Homo sapiens CHEMBL4672963 cell-based format
CHEMBL1278223 OBDepict CH 3 HN O N N O F F F IC50 = 5.0 nM 373.33 Cc1cccc(NC(=O)c2cncc(-c3ccc(OC(F)(F)F)cc3)n2)c1 Homo sapiens CHEMBL1286452 cell-based format
CHEMBL4788313 OBDepict O N H N N N S F F F O O NH 2 F F IC50 = 5.3 nM 479.43 NS(=O)(=O)c1cc(NC(=O)c2ccc(C(F)(F)F)nc2N2CCCC(F)(F)CC2)ccn1 Homo sapiens CHEMBL4672963 cell-based format
CHEMBL4752525 OBDepict Cl N N HN O F F N S O O NH 2 IC50 = 5.8 nM 445.88 NS(=O)(=O)c1cc(NC(=O)c2ccc(Cl)nc2N2CCCC(F)(F)CC2)ccn1 Homo sapiens CHEMBL4672963 cell-based format
CHEMBL1277513 OBDepict Cl N N N H O CH 3 IC50 = 6.0 nM 323.78 Cc1cccc(NC(=O)c2cncc(-c3ccc(Cl)cc3)n2)c1 Homo sapiens CHEMBL1286452 cell-based format
CHEMBL1277512 OBDepict CH 3 O HN O H 3 C O N N Cl IC50 = 6.0 nM 369.81 COc1cc(NC(=O)c2cncc(-c3ccc(Cl)cc3)n2)cc(OC)c1 Homo sapiens CHEMBL1286452 cell-based format
CHEMBL4753100 OBDepict O N H N N CH 3 N S O O NH 2 F F IC50 = 6.5 nM 465.53 Cc1nc(N2CCC(F)(F)CC2)c(C(=O)Nc2ccnc(S(N)(=O)=O)c2)cc1C1CCC1 Homo sapiens CHEMBL4672963 cell-based format
CHEMBL1270207 OBDepict H 3 C O N HN O N Cl IC50 = 7.0 nM 367.84 CCOc1ncccc1CNC(=O)c1cncc(-c2ccc(Cl)cc2)c1 Homo sapiens CHEMBL1272888 single protein format
CHEMBL1271105 OBDepict CH 3 N H H 3 C O N N S O F F F IC50 = 8.0 nM 393.39 Cc1cc(C)cc(NC(=O)c2nsc(-c3ccc(OC(F)(F)F)cc3)n2)c1 Homo sapiens CHEMBL1272888 single protein format
CHEMBL250699 OBDepict CH 3 O N H O CH 3 O O Cl IC50 = 8.0 nM 357.79 COc1cc(NC(=O)c2ccc(-c3ccc(Cl)cc3)o2)cc(OC)c1 Homo sapiens CHEMBL944730 cell-based format
CHEMBL1278044 OBDepict N N N N H O CH 3 CH 3 IC50 = 8.0 nM 328.38 Cc1cc(C)cc(NC(=O)c2cncc(-c3ccc(C#N)cc3)n2)c1 Homo sapiens CHEMBL1286452 cell-based format
CHEMBL1269990 OBDepict Cl N N H O N IC50 = 8.0 nM 405.93 O=C(NCc1ccccc1N1CCCCC1)c1cncc(-c2ccc(Cl)cc2)c1 Homo sapiens CHEMBL1272888 single protein format
CHEMBL1271416 OBDepict Cl N N H O H 3 C CH 3 IC50 = 9.0 nM 336.82 Cc1cc(C)cc(NC(=O)c2cncc(-c3ccc(Cl)cc3)c2)c1 Homo sapiens CHEMBL1272888 single protein format
CHEMBL1269991 OBDepict Cl N N H O N O IC50 = 10.0 nM 407.9 O=C(NCc1ccccc1N1CCOCC1)c1cncc(-c2ccc(Cl)cc2)c1 Homo sapiens CHEMBL1272888 single protein format
CHEMBL3617059 OBDepict CH 3 O CH 3 H NH 2 H N N H F N IC50 = 10.5 nM 324.36 CO[C@H](C)[C@H](N)c1nc2cc(-c3ccc(C#N)c(F)c3)ccc2[nH]1 Homo sapiens CHEMBL3618960 cell-based format
CHEMBL4763229 OBDepict O NH N N CH 3 N S O O NH 2 F F IC50 = 12.0 nM 475.52 Cc1nc(N2CCC(F)(F)CC2)c(C(=O)Nc2ccnc(S(N)(=O)=O)c2)cc1C#CC1CC1 Homo sapiens CHEMBL4672963 cell-based format
CHEMBL1270301 OBDepict Cl N N H O N N IC50 = 14.0 nM 406.92 O=C(NCc1cccnc1N1CCCCC1)c1cncc(-c2ccc(Cl)cc2)c1 Homo sapiens CHEMBL1272888 single protein format
CHEMBL4297317 OBDepict NH 2 O H 3 C H NH 2 H N N H H 3 C H 3 C CH 3 IC50 = 15.0 nM 274.37 C[C@@H](C(N)=O)[C@H](N)c1nc2ccc(C(C)(C)C)cc2[nH]1 Homo sapiens CHEMBL4331778 cell-based format
CHEMBL1278224 OBDepict O N H N N CH 3 O F F F IC50 = 18.0 nM 387.36 Cc1ccccc1CNC(=O)c1cncc(-c2ccc(OC(F)(F)F)cc2)n1 Homo sapiens CHEMBL1286452 cell-based format
CHEMBL4455868 OBDepict H 3 C O H 3 C H H 2 N H N N H F N IC50 = 18.0 nM 324.36 CO[C@H](C)[C@H](N)c1nc2cc(-c3ccc(C#N)cc3F)ccc2[nH]1 Homo sapiens CHEMBL4331778 cell-based format
CHEMBL1276882 OBDepict O N H N N N N O O F F F IC50 = 19.0 nM 459.43 O=C(NCc1cccnc1N1CCOCC1)c1cncc(-c2ccc(OC(F)(F)F)cc2)n1 Homo sapiens CHEMBL1286452 cell-based format
CHEMBL1277607 OBDepict Cl HN O N N Cl IC50 = 19.0 nM 372.26 O=C(NCCc1ccc(Cl)cc1)c1cncc(-c2ccc(Cl)cc2)n1 Homo sapiens CHEMBL1286452 cell-based format
CHEMBL1271106 OBDepict CH 3 HN CH 3 O N N O F F F IC50 = 21.0 nM 387.36 Cc1cc(C)cc(NC(=O)c2cncc(-c3ccc(OC(F)(F)F)cc3)n2)c1 Homo sapiens CHEMBL1272888 single protein format
CHEMBL1271417 OBDepict Cl N N H O IC50 = 22.0 nM 322.8 O=C(NCc1ccccc1)c1cncc(-c2ccc(Cl)cc2)c1 Homo sapiens CHEMBL1272888 single protein format
CHEMBL1271309 OBDepict N N N H O CH 3 CH 3 IC50 = 23.0 nM 327.39 Cc1cc(C)cc(NC(=O)c2cncc(-c3ccc(C#N)cc3)c2)c1 Homo sapiens CHEMBL1272888 single protein format
CHEMBL4474590 OBDepict CH 3 O CH 3 H NH 2 H N N H H 3 C CH 3 H 3 C IC50 = 24.0 nM 261.37 CO[C@H](C)[C@H](N)c1nc2cc(C(C)(C)C)ccc2[nH]1 Homo sapiens CHEMBL4331778 cell-based format
CHEMBL1271206 OBDepict CH 3 HN CH 3 O N O F F F IC50 = 26.0 nM 386.37 Cc1cc(C)cc(NC(=O)c2cncc(-c3ccc(OC(F)(F)F)cc3)c2)c1 Homo sapiens CHEMBL1272888 single protein format
CHEMBL1277606 OBDepict Cl N N N H O CH 3 IC50 = 27.0 nM 337.81 Cc1ccccc1CNC(=O)c1cncc(-c2ccc(Cl)cc2)n1 Homo sapiens CHEMBL1286452 cell-based format
CHEMBL1277876 OBDepict Cl N N HN O N N IC50 = 30.0 nM 393.88 O=C(NCc1cccnc1N1CCCC1)c1cncc(-c2ccc(Cl)cc2)n1 Homo sapiens CHEMBL1286452 cell-based format
CHEMBL486495 OBDepict O N O N CH 3 CH 3 H 3 C IC50 = 30.0 nM 394.56 CC(C)(C)c1ccc(-c2ccc(C(=O)N3CCN(C4CCCCC4)CC3)o2)cc1 Homo sapiens CHEMBL954007 cell-based format
CHEMBL4562194 OBDepict H N N H NH H HO CH 3 CH 3 CH 3 IC50 = 31.0 nM 259.35 CC(C)(C)c1ccc2[nH]c([C@H]3C[C@@H](O)CN3)nc2c1 Homo sapiens CHEMBL4331778 cell-based format
CHEMBL4091868 OBDepict H N N NH 2 H O O F F F IC50 = 36.0 nM 377.37 N[C@H](COCc1ccccc1)c1nc(-c2ccc(OC(F)(F)F)cc2)c[nH]1 Homo sapiens CHEMBL3992696 cell-based format
CHEMBL1277700 OBDepict Cl N N N H O N N O IC50 = 37.0 nM 409.88 O=C(NCc1cccnc1N1CCOCC1)c1cncc(-c2ccc(Cl)cc2)n1 Homo sapiens CHEMBL1286452 cell-based format
CHEMBL4564889 OBDepict H N N H NH CH 3 CH 3 CH 3 IC50 = 43.0 nM 243.35 CC(C)(C)c1ccc2[nH]c([C@H]3CCCN3)nc2c1 Homo sapiens CHEMBL4331778 cell-based format
CHEMBL4457824 OBDepict CH 3 CH 3 N N H NH 2 H OH H 3 C H IC50 = 43.0 nM 233.31 CC(C)c1ccc2[nH]c([C@@H](N)[C@@H](C)O)nc2c1 Homo sapiens CHEMBL4331778 cell-based format
CHEMBL4452291 OBDepict NH 2 O H 3 C H H 2 N H N N CH 3 H 3 C CH 3 IC50 = 45.0 nM 274.37 C[C@@H](C(N)=O)[C@H](N)c1cn2cc(C(C)(C)C)ccc2n1 Homo sapiens CHEMBL4331778 cell-based format
CHEMBL4096468 OBDepict H N N NH 2 O O F F F IC50 = 47.0 nM 313.28 NC1(Cc2nc(-c3ccc(OC(F)(F)F)cc3)c[nH]2)COC1 Homo sapiens CHEMBL3992696 cell-based format
CHEMBL1278045 OBDepict N N N N H O O CH 3 CH 3 IC50 = 49.0 nM 358.4 CC(C)Oc1cccc(NC(=O)c2cncc(-c3ccc(C#N)cc3)n2)c1 Homo sapiens CHEMBL1286452 cell-based format
CHEMBL1270999 OBDepict CH 3 N H H 3 C O N S O F F F IC50 = 51.0 nM 392.4 Cc1cc(C)cc(NC(=O)c2csc(-c3ccc(OC(F)(F)F)cc3)n2)c1 Homo sapiens CHEMBL1272888 single protein format
CHEMBL4084106 OBDepict H N N NH 2 CH 3 CH 3 O F F F IC50 = 53.0 nM 285.27 CC(C)(N)c1nc(-c2ccc(OC(F)(F)F)cc2)c[nH]1 Homo sapiens CHEMBL3992696 cell-based format
CHEMBL4571436 OBDepict H N N NH 2 H HO CH 3 H H 3 C CH 3 H 3 C IC50 = 59.0 nM 247.34 C[C@@H](O)[C@H](N)c1nc2cc(C(C)(C)C)ccc2[nH]1 Homo sapiens CHEMBL4331778 cell-based format
CHEMBL1271205 OBDepict CH 3 HN CH 3 O N O F F F IC50 = 64.0 nM 386.37 Cc1cc(C)cc(NC(=O)c2cccc(-c3ccc(OC(F)(F)F)cc3)n2)c1 Homo sapiens CHEMBL1272888 single protein format
CHEMBL4546247 OBDepict HO NH 2 H 3 C N N H CH 3 CH 3 CH 3 IC50 = 65.0 nM 247.34 CC(C)(C)c1ccc2[nH]c([C@@](C)(N)CO)nc2c1 Homo sapiens CHEMBL4331778 cell-based format
CHEMBL401258 OBDepict N O N H O CH 3 IC50 = 79.0 nM 302.33 Cc1cccc(NC(=O)c2ccc(-c3ccc(C#N)cc3)o2)c1 Homo sapiens CHEMBL944730 cell-based format
CHEMBL4069225 OBDepict CH 3 O NH 2 H 3 C N N H O F F F IC50 = 84.0 nM 315.3 COC[C@@](C)(N)c1nc(-c2ccc(OC(F)(F)F)cc2)c[nH]1 Homo sapiens CHEMBL3992696 cell-based format
CHEMBL1270302 OBDepict Cl N N H O N N O IC50 = 87.0 nM 408.89 O=C(NCc1cccnc1N1CCOCC1)c1cncc(-c2ccc(Cl)cc2)c1 Homo sapiens CHEMBL1272888 single protein format
CHEMBL4521566 OBDepict H N N NH 2 H HO CH 3 H S F F F F F IC50 = 95.0 nM 317.28 C[C@@H](O)[C@H](N)c1nc2cc(S(F)(F)(F)(F)F)ccc2[nH]1 Homo sapiens CHEMBL4331778 cell-based format
CHEMBL1276881 OBDepict O N H N N Cl N O F F F IC50 = 99.0 nM 408.77 O=C(NCc1cccnc1Cl)c1cncc(-c2ccc(OC(F)(F)F)cc2)n1 Homo sapiens CHEMBL1286452 cell-based format
CHEMBL1271415 OBDepict F N N H O H 3 C CH 3 IC50 = 100.0 nM 320.37 Cc1cc(C)cc(NC(=O)c2cncc(-c3ccc(F)cc3)c2)c1 Homo sapiens CHEMBL1272888 single protein format
CHEMBL4468605 OBDepict HO NH 2 H N N H CH 3 CH 3 CH 3 IC50 = 106.0 nM 233.31 CC(C)(C)c1ccc2[nH]c([C@@H](N)CO)nc2c1 Homo sapiens CHEMBL4331778 cell-based format
CHEMBL3932839 OBDepict O N N NH H CH 3 O N F F F IC50 = 120.0 nM 416.4 C[C@@H]1CN(C(=O)c2ccc3cc(Oc4ccc(C(F)(F)F)nc4)ccc3n2)CCN1 Homo sapiens CHEMBL3889156 cell-based format
CHEMBL3341974 OBDepict H 3 C CH 3 H 2 N H N N H CH 3 H 3 C CH 3 IC50 = 127.0 nM 273.42 CC(C)CC[C@H](N)c1nc2cc(C(C)(C)C)ccc2[nH]1 Homo sapiens CHEMBL3368011 cell-based format
CHEMBL4590816 OBDepict H 2 N O NH 2 H N N H CH 3 CH 3 CH 3 IC50 = 130.0 nM 260.34 CC(C)(C)c1ccc2[nH]c([C@H](N)CC(N)=O)nc2c1 Homo sapiens CHEMBL4331778 cell-based format
CHEMBL1270100 OBDepict Cl N N H O Cl N IC50 = 140.0 nM 358.23 O=C(NCc1cccnc1Cl)c1cncc(-c2ccc(Cl)cc2)c1 Homo sapiens CHEMBL1272888 single protein format
CHEMBL1631102 OBDepict F O N F F F F F N O NH 2 O H 2 N IC50 = 149.0 nM 472.35 NC(=O)c1cc(C(N)=O)n(-c2cccc(-c3cc(F)ccc3OCC(F)(F)C(F)(F)F)c2)n1 Homo sapiens CHEMBL1633015 single protein format
CHEMBL1278138 OBDepict N N N N H O CH 3 IC50 = 150.0 nM 328.38 Cc1ccccc1CNC(=O)c1cncc(-c2ccc(C#N)cc2)n1 Homo sapiens CHEMBL1286452 cell-based format
CHEMBL3589893 OBDepict CH 3 N H O N H 2 N Cl Cl Cl IC50 = 160.0 nM 330.6 CC(=O)Nc1ccc(-c2cc(Cl)cc(Cl)c2Cl)c(N)n1 Homo sapiens CHEMBL3590772 cell-based format
CHEMBL205412 OBDepict O HN H H N O CH 3 O F F F S O O H 2 N Ki = 180.0 nM 589.64 CN(Cc1ccc(-c2ccccc2S(N)(=O)=O)cc1)C(=O)[C@@H]1CCC[C@H]1C(=O)NCc1ccc(OC(F)(F)F)cc1 Homo sapiens CHEMBL926139 single protein format
CHEMBL1270899 OBDepict CH 3 N H H 3 C O N O O F F F IC50 = 180.0 nM 376.33 Cc1cc(C)cc(NC(=O)c2coc(-c3ccc(OC(F)(F)F)cc3)n2)c1 Homo sapiens CHEMBL1272888 single protein format
CHEMBL3341975 OBDepict H N N NH 2 O O F F F IC50 = 190.0 nM 341.33 NC1(Cc2nc(-c3ccc(OC(F)(F)F)cc3)c[nH]2)CCCOC1 Homo sapiens CHEMBL3368011 cell-based format
CHEMBL3589894 OBDepict CH 3 HN O N H 2 N Cl Cl Cl IC50 = 190.0 nM 330.6 CNC(=O)c1ccc(-c2cc(Cl)cc(Cl)c2Cl)c(N)n1 Homo sapiens CHEMBL3590899 cell-based format
CHEMBL1631103 OBDepict H 2 N O N N O NH 2 O O F F F F F F F F IC50 = 203.0 nM 538.35 NC(=O)c1cc(C(N)=O)n(-c2cccc(-c3cccc(OC(F)(F)F)c3OCC(F)(F)C(F)(F)F)c2)n1 Homo sapiens CHEMBL1633015 single protein format
CHEMBL3955151 OBDepict O NH H HN O N O N F F F IC50 = 213.0 nM 430.39 O=C1C[C@@H](NC(=O)c2ccc3cc(Oc4ccc(C(F)(F)F)cn4)ccc3n2)CCN1 Homo sapiens CHEMBL3889156 cell-based format
CHEMBL4583673 OBDepict H 3 C H 3 C OH H H 2 N H N N H CH 3 H 3 C CH 3 IC50 = 227.0 nM 275.4 CC(C)[C@@H](O)[C@H](N)c1nc2cc(C(C)(C)C)ccc2[nH]1 Homo sapiens CHEMBL4331778 cell-based format
CHEMBL4089820 OBDepict NH 2 H 3 C CH 3 N N H O F F F IC50 = 230.0 nM 299.3 CC(C)(CN)c1nc(-c2ccc(OC(F)(F)F)cc2)c[nH]1 Homo sapiens CHEMBL3992696 cell-based format
CHEMBL4081959 OBDepict H N N H 2 N CH 3 H O F F F IC50 = 260.0 nM 285.27 C[C@H](N)Cc1nc(-c2ccc(OC(F)(F)F)cc2)c[nH]1 Homo sapiens CHEMBL3992696 cell-based format
CHEMBL254497 OBDepict O HN O H CH 3 CH 3 H 3 C HN O N N F F F N IC50 = 270.0 nM 553.59 CC(C)(C)OC(=O)N[C@H](Cc1ccccc1C(F)(F)F)C(=O)NCc1nc2cccnc2n1Cc1ccccc1 Homo sapiens CHEMBL928309 cell-based format
CHEMBL1270898 OBDepict CH 3 N H H 3 C O O N O F F F IC50 = 280.0 nM 376.33 Cc1cc(C)cc(NC(=O)c2cnc(-c3ccc(OC(F)(F)F)cc3)o2)c1 Homo sapiens CHEMBL1272888 single protein format