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Q15858 | SCN9A_HUMAN | Sodium channel protein type 9 subunit alpha (SCN9A)

3D structures mapped by conservation among orthologs

[ Domain: "Voltage-gated ion channels" // Ion_trans ]

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[ 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
CHEMBL1224266 OBDepict Cl N N O NH 2 Ki = 0.018 nM 297.75 NC(=O)n1ccc(-c2cccc(-c3ccccc3Cl)c2)n1 Homo sapiens CHEMBL1225825 single protein format
CHEMBL4640389 OBDepict F N H F F F O S HN O O N N IC50 = 0.11 nM 530.5 O=S(=O)(Nc1ccncn1)c1ccc2c(c1)OCC[C@@H]2c1ccc(C(F)(F)F)cc1-c1ccc(F)nc1 Homo sapiens CHEMBL4629712 cell-based format
CHEMBL1224265 OBDepict Cl N N O H 2 N Ki = 0.111 nM 297.75 NC(=O)n1ccc(-c2ccc(-c3ccccc3Cl)cc2)n1 Homo sapiens CHEMBL1225825 single protein format
CHEMBL3955386 OBDepict Cl O F O N N F CH 3 H 3 C S HN O O N S N IC50 = 0.2 nM 564.0 CN(C)c1noc2ccc(-c3cc(Cl)ccc3Oc3cc(F)c(S(=O)(=O)Nc4ncns4)cc3F)cc12 Homo sapiens CHEMBL3889237 cell-based format
CHEMBL3657851 OBDepict O N H S F O O CH 3 O IC50 = 0.3 nM 421.53 CS(=O)(=O)NC(=O)c1cc(C2CC2)c(OCC23CC4CC(CC(C4)C2)C3)cc1F Homo sapiens CHEMBL3707743 cell-based format
CHEMBL3965272 OBDepict Cl O N F O H F O S HN O O N S N IC50 = 0.3 nM 536.93 O=c1[nH]c2cc(-c3cc(Cl)ccc3Oc3cc(F)c(S(=O)(=O)Nc4ncns4)cc3F)ccc2o1 Homo sapiens CHEMBL3889237 cell-based format
CHEMBL4462278 OBDepict H N N H N H H F F F O F S HN O O N N Ki = 0.32 nM 526.52 O=S(=O)(Nc1ccncn1)c1cc2c(cc1F)[C@@H](N1CC[C@H](C(F)(F)F)C[C@@H]1c1cc[nH]n1)CCO2 Homo sapiens CHEMBL4386329 cell-based format
CHEMBL4646742 OBDepict H 3 C N N H F F F O S NH O O N S IC50 = 0.4 nM 520.56 Cn1nccc1-c1cc(C(F)(F)F)ccc1[C@H]1CCOc2cc(S(=O)(=O)Nc3nccs3)ccc21 Homo sapiens CHEMBL4629712 cell-based format
CHEMBL3657855 OBDepict F O N H O S N O O IC50 = 0.4 nM 462.59 O=C(NS(=O)(=O)N1CCC1)c1cc(C2CC2)c(OCC23CC4CC(CC(C4)C2)C3)cc1F Homo sapiens CHEMBL3707743 cell-based format
CHEMBL4634421 OBDepict F N H F F F O S HN O O N S IC50 = 0.4 nM 535.54 O=S(=O)(Nc1nccs1)c1ccc2c(c1)OCC[C@@H]2c1ccc(C(F)(F)F)cc1-c1ccc(F)nc1 Homo sapiens CHEMBL4629712 cell-based format
CHEMBL3957974 OBDepict Cl O O NH 2 N F F S NH O O N S N IC50 = 0.5 nM 535.94 Nc1noc2ccc(-c3cc(Cl)ccc3Oc3cc(F)c(S(=O)(=O)Nc4ncns4)c(F)c3)cc12 Homo sapiens CHEMBL3889237 cell-based format
CHEMBL4282994 OBDepict F H N H H F F F O F S HN O O N N IC50 = 0.5 nM 554.54 O=S(=O)(Nc1ccncn1)c1cc2c(cc1F)[C@@H](N1CC[C@H](C(F)(F)F)C[C@@H]1c1ccc(F)cc1)CCO2 Homo sapiens CHEMBL4266780 single protein format
CHEMBL3806065 OBDepict H 3 C HN N O O Cl F F S NH O O N S N IC50 = 0.5 nM 549.97 CNc1noc2ccc(-c3cc(Cl)ccc3Oc3cc(F)c(S(=O)(=O)Nc4ncns4)cc3F)cc12 Homo sapiens CHEMBL3806691 cell-based format
CHEMBL4642748 OBDepict O S HN O N S O H N N N F F F IC50 = 0.5 nM 507.52 O=S(=O)(Nc1nccs1)c1ccc2c(c1)OCC[C@@H]2c1ccc(C(F)(F)F)cc1-n1ccnn1 Homo sapiens CHEMBL4629712 cell-based format
CHEMBL4636838 OBDepict F H F F F O S HN O O N S IC50 = 0.5 nM 534.56 O=S(=O)(Nc1nccs1)c1ccc2c(c1)OCC[C@@H]2c1ccc(C(F)(F)F)cc1-c1ccc(F)cc1 Homo sapiens CHEMBL4629712 cell-based format
CHEMBL4543884 OBDepict H N N H N H H F F F O F S HN O O N N Ki = 0.51 nM 526.52 O=S(=O)(Nc1ccncn1)c1cc2c(cc1F)[C@@H](N1CC[C@H](C(F)(F)F)C[C@@H]1c1cn[nH]c1)CCO2 Homo sapiens CHEMBL4386329 cell-based format
CHEMBL4282994 OBDepict F H N H H F F F O F S HN O O N N Ki = 0.53 nM 554.54 O=S(=O)(Nc1ccncn1)c1cc2c(cc1F)[C@@H](N1CC[C@H](C(F)(F)F)C[C@@H]1c1ccc(F)cc1)CCO2 Homo sapiens CHEMBL4386329 cell-based format
CHEMBL4444408 OBDepict F F F H N H H O S HN O O N S N IC50 = 0.57 nM 524.59 O=S(=O)(Nc1ncns1)c1ccc2c(c1)OCC[C@@H]2N1CC[C@H](C(F)(F)F)C[C@@H]1c1ccccc1 Homo sapiens CHEMBL4386295 cell-based format
CHEMBL3341983 OBDepict Cl O F O NH 2 N F S NH O O N S N IC50 = 0.6 nM 535.94 Nc1noc2ccc(-c3cc(Cl)ccc3Oc3cc(F)c(S(=O)(=O)Nc4ncns4)cc3F)cc12 Homo sapiens CHEMBL3368016 single protein format
CHEMBL4633361 OBDepict F N NH S O O O H N CH 3 N F F F IC50 = 0.6 nM 532.52 Cn1nccc1-c1cc(C(F)(F)F)ccc1[C@H]1CCOc2cc(S(=O)(=O)Nc3cccc(F)n3)ccc21 Homo sapiens CHEMBL4629712 cell-based format
CHEMBL254707 OBDepict O N H O H CH 3 CH 3 CH 3 N H O H N O N F F F Ki = 0.63 nM 560.62 CC(C)(C)OC(=O)N[C@H](Cc1ccccc1)C(=O)N[C@@H]1CN(CC2CC2)c2ccccc2N(CC(F)(F)F)C1=O Homo sapiens CHEMBL929682 cell-based format
CHEMBL4543422 OBDepict F S HN O O N N O H N H H N F F F Ki = 0.68 nM 537.54 O=S(=O)(Nc1ccncn1)c1cc2c(cc1F)[C@@H](N1CC[C@H](C(F)(F)F)C[C@@H]1c1cccnc1)CCO2 Homo sapiens CHEMBL4386329 cell-based format
CHEMBL3910564 OBDepict CH 3 O N F O H F O S NH O O N S N IC50 = 0.7 nM 516.51 Cc1ccc(Oc2cc(F)c(S(=O)(=O)Nc3ncns3)cc2F)c(-c2ccc3oc(=O)[nH]c3c2)c1 Homo sapiens CHEMBL3889237 cell-based format
CHEMBL4473871 OBDepict CH 3 N N H N H H F F F O F S N H O O N N Ki = 0.76 nM 540.54 Cn1ccc([C@H]2C[C@@H](C(F)(F)F)CCN2[C@H]2CCOc3cc(S(=O)(=O)Nc4ccncn4)c(F)cc32)n1 Homo sapiens CHEMBL4386329 cell-based format
CHEMBL4464990 OBDepict F S HN O O N N O H N H N H F F F Ki = 0.79 nM 537.54 O=S(=O)(Nc1ccncn1)c1cc2c(cc1F)[C@@H](N1CC[C@H](C(F)(F)F)C[C@@H]1c1ccccn1)CCO2 Homo sapiens CHEMBL4386329 cell-based format
CHEMBL4649638 OBDepict O S HN O N S O H N F F F HN IC50 = 0.8 nM 524.59 O=S(=O)(Nc1nccs1)c1ccc2c(c1)OCC[C@@H]2c1ccc(C(F)(F)F)cc1N1CCNCC1 Homo sapiens CHEMBL4629712 cell-based format
CHEMBL3925113 OBDepict Cl O O F N F H 2 N S HN O O N S N IC50 = 0.8 nM 535.94 Nc1nc2ccc(-c3cc(Cl)ccc3Oc3cc(F)c(S(=O)(=O)Nc4ncns4)cc3F)cc2o1 Homo sapiens CHEMBL3889237 cell-based format
CHEMBL4519170 OBDepict F H N H H F F F O S HN O O N S N Ki = 0.85 nM 542.58 O=S(=O)(Nc1ncns1)c1ccc2c(c1)OCC[C@@H]2N1CC[C@H](C(F)(F)F)C[C@@H]1c1ccc(F)cc1 Homo sapiens CHEMBL4386329 cell-based format
CHEMBL3617062 OBDepict F O S F HN O O N S N H HN H F Cl IC50 = 0.9 nM 518.97 O=S(=O)(Nc1ncns1)c1cc(F)c(OC[C@@H]2CNCC[C@H]2c2ccc(Cl)c(F)c2)cc1F Homo sapiens CHEMBL3618957 cell-based format
CHEMBL3325528 OBDepict F O S F HN O O N S N H HN H F Cl IC50 = 0.9 nM 518.97 O=S(=O)(Nc1ncns1)c1cc(F)c(OC[C@H]2CNCC[C@@H]2c2ccc(Cl)c(F)c2)cc1F Homo sapiens CHEMBL3390669 cell-based format
CHEMBL4446868 OBDepict CH 3 N N H N H H F F F O F S N H O O N N Ki = 0.93 nM 540.54 Cn1nccc1[C@H]1C[C@@H](C(F)(F)F)CCN1[C@H]1CCOc2cc(S(=O)(=O)Nc3ccncn3)c(F)cc21 Homo sapiens CHEMBL4386329 cell-based format
CHEMBL4444408 OBDepict F F F H N H H O S HN O O N S N Ki = 0.97 nM 524.59 O=S(=O)(Nc1ncns1)c1ccc2c(c1)OCC[C@@H]2N1CC[C@H](C(F)(F)F)C[C@@H]1c1ccccc1 Homo sapiens CHEMBL4386329 cell-based format
CHEMBL4530176 OBDepict F S HN O O N N O H N H O H N F F F Ki = 1.0 nM 527.5 O=S(=O)(Nc1ccncn1)c1cc2c(cc1F)[C@@H](N1CC[C@H](C(F)(F)F)C[C@@H]1c1cnco1)CCO2 Homo sapiens CHEMBL4386329 cell-based format
CHEMBL3963109 OBDepict Cl O N F O F S HN O O N S N IC50 = 1.0 nM 520.93 O=S(=O)(Nc1ncns1)c1cc(F)c(Oc2ccc(Cl)cc2-c2ccc3ocnc3c2)cc1F Homo sapiens CHEMBL3889237 cell-based format
CHEMBL3657947 OBDepict CH 3 S N H O O O F O IC50 = 1.0 nM 435.56 CCS(=O)(=O)NC(=O)c1cc(C2CC2)c(OCC23CC4CC(CC(C4)C2)C3)cc1F Homo sapiens CHEMBL3705617 assay format
CHEMBL3906826 OBDepict O NH O Cl F F S NH O O N S N IC50 = 1.0 nM 534.95 O=C1Cc2ccc(-c3cc(Cl)ccc3Oc3cc(F)c(S(=O)(=O)Nc4ncns4)cc3F)cc2N1 Homo sapiens CHEMBL3889237 cell-based format
CHEMBL3662236 OBDepict O HN S F O O CH 3 O IC50 = 1.0 nM 369.46 CS(=O)(=O)NC(=O)c1cc(C2CC2)c(OCC2CCCCC2)cc1F Homo sapiens CHEMBL3707743 cell-based format
CHEMBL3657937 OBDepict F O N H O S O O CH 3 F F IC50 = 1.0 nM 457.51 CS(=O)(=O)NC(=O)c1cc(C2CC2)c(OCC23CC4CC(C2)C(F)(F)C(C4)C3)cc1F Homo sapiens CHEMBL3705617 assay format
CHEMBL3786105 OBDepict O S HN O N S O F F F N H IC50 = 1.0 nM 521.59 O=S(=O)(Nc1nccs1)c1ccc2c(c1)OCCC2c1ccc(C(F)(F)F)cc1C1=CCNCC1 Homo sapiens CHEMBL3789454 cell-based format
CHEMBL3662238 OBDepict F O N H O S N O O IC50 = 1.0 nM 410.51 O=C(NS(=O)(=O)N1CCC1)c1cc(C2CC2)c(OCC2CCCCC2)cc1F Homo sapiens CHEMBL3707743 cell-based format
CHEMBL3325526 OBDepict H N H O H F F Cl S HN O O N S N IC50 = 1.1 nM 500.98 O=S(=O)(Nc1ncns1)c1cc(F)c(OC[C@H]2CNCC[C@@H]2c2ccc(Cl)cc2)cc1F Homo sapiens CHEMBL3390669 cell-based format
CHEMBL4636970 OBDepict F N HN S O O O H N N N F F F IC50 = 1.1 nM 519.48 O=S(=O)(Nc1cccc(F)n1)c1ccc2c(c1)OCC[C@@H]2c1ccc(C(F)(F)F)cc1-n1ccnn1 Homo sapiens CHEMBL4629712 cell-based format
CHEMBL3617054 OBDepict Cl O S F HN O O N S N N N F F F N H IC50 = 1.1 nM 574.97 O=S(=O)(Nc1nncs1)c1cc(Cl)c(Oc2ccc(C(F)(F)F)cc2-c2ccnn2C2CNC2)cc1F Homo sapiens CHEMBL3618958 cell-based format
CHEMBL3907762 OBDepict Cl O N N F F H H 2 N S HN O O N S N IC50 = 1.2 nM 534.96 Nc1nc2cc(-c3cc(Cl)ccc3Oc3cc(F)c(S(=O)(=O)Nc4ncns4)c(F)c3)ccc2[nH]1 Homo sapiens CHEMBL3889237 cell-based format
CHEMBL4557850 OBDepict F H N H H F F F O F S HN O O N O Ki = 1.3 nM 543.51 O=S(=O)(Nc1ccon1)c1cc2c(cc1F)[C@@H](N1CC[C@H](C(F)(F)F)C[C@@H]1c1ccc(F)cc1)CCO2 Homo sapiens CHEMBL4386329 cell-based format
CHEMBL3968176 OBDepict CH 3 O Cl F O CH 3 N O N S NH O O N O IC50 = 1.3 nM 560.99 COc1cc(Cl)cc(-c2cc(OC)c(-n3c4c(ccc3=O)CN(S(=O)(=O)Nc3ccon3)CC4)cc2F)c1 Homo sapiens CHEMBL3879709 cell-based format
CHEMBL3657877 OBDepict O NH S O O CH 3 O IC50 = 1.31 nM 403.54 CS(=O)(=O)NC(=O)c1ccc(OCC23CC4CC(CC(C4)C2)C3)c(C2CC2)c1 Homo sapiens CHEMBL3707743 cell-based format
CHEMBL3928901 OBDepict Cl O N F O F H 2 N S HN O O N S N IC50 = 1.4 nM 535.94 Nc1nc2cc(-c3cc(Cl)ccc3Oc3cc(F)c(S(=O)(=O)Nc4ncns4)cc3F)ccc2o1 Homo sapiens CHEMBL3889237 cell-based format
CHEMBL4649472 OBDepict H 3 C N H F F F O S HN O O N N IC50 = 1.4 nM 526.54 Cc1ccc(-c2cc(C(F)(F)F)ccc2[C@H]2CCOc3cc(S(=O)(=O)Nc4ncccn4)ccc32)cn1 Homo sapiens CHEMBL4629712 cell-based format
CHEMBL3657932 OBDepict O N H S F O O O IC50 = 1.4 nM 447.57 O=C(NS(=O)(=O)C1CC1)c1cc(C2CC2)c(OCC23CC4CC(CC(C4)C2)C3)cc1F Homo sapiens CHEMBL3707743 cell-based format
CHEMBL3912540 OBDepict Cl O N F N F H S F F F HN O O N S N IC50 = 1.4 nM 587.94 O=S(=O)(Nc1ncns1)c1cc(F)c(Oc2ccc(Cl)cc2-c2ccc3[nH]c(C(F)(F)F)nc3c2)cc1F Homo sapiens CHEMBL3889237 cell-based format
CHEMBL4474681 OBDepict F S HN O O N N O H N H N H F F F N Ki = 1.5 nM 538.53 O=S(=O)(Nc1ccncn1)c1cc2c(cc1F)[C@@H](N1CC[C@H](C(F)(F)F)C[C@@H]1c1ccncn1)CCO2 Homo sapiens CHEMBL4386329 cell-based format
CHEMBL2325603 OBDepict N O S NH O O N S N Cl N IC50 = 1.6 nM 538.05 N#Cc1cc(S(=O)(=O)Nc2ncns2)ccc1Oc1ccc(Cl)cc1-c1cccc(CN2CCC2)c1 Homo sapiens CHEMBL4179762 cell-based format
CHEMBL4639872 OBDepict H 3 C O N H F F F O S HN O O N F IC50 = 1.6 nM 533.5 Cc1nc(-c2cc(C(F)(F)F)ccc2[C@H]2CCOc3cc(S(=O)(=O)Nc4cccc(F)n4)ccc32)co1 Homo sapiens CHEMBL4629712 cell-based format
CHEMBL4635247 OBDepict O S HN O N S O H N S F F F IC50 = 1.6 nM 523.58 O=S(=O)(Nc1nccs1)c1ccc2c(c1)OCC[C@@H]2c1ccc(C(F)(F)F)cc1-c1nccs1 Homo sapiens CHEMBL4629712 cell-based format
CHEMBL4444085 OBDepict F S HN O O N N O H N H H F F F N Ki = 1.7 nM 537.54 O=S(=O)(Nc1ccncn1)c1cc2c(cc1F)[C@@H](N1CC[C@H](C(F)(F)F)C[C@@H]1c1ccncc1)CCO2 Homo sapiens CHEMBL4386329 cell-based format
CHEMBL3805722 OBDepict Cl O N F N F H S HN O O N S N IC50 = 1.7 nM 519.94 O=S(=O)(Nc1ncns1)c1cc(F)c(Oc2ccc(Cl)cc2-c2ccc3[nH]cnc3c2)cc1F Homo sapiens CHEMBL3806691 cell-based format
CHEMBL3805837 OBDepict F O F O NH 2 N F S NH O O N S N IC50 = 1.7 nM 519.49 Nc1noc2ccc(-c3cc(F)ccc3Oc3cc(F)c(S(=O)(=O)Nc4ncns4)cc3F)cc12 Homo sapiens CHEMBL3806691 cell-based format
CHEMBL3805973 OBDepict Cl O N F N H F H O S HN O O N S N IC50 = 1.7 nM 535.94 O=c1[nH]c2ccc(-c3cc(Cl)ccc3Oc3cc(F)c(S(=O)(=O)Nc4ncns4)cc3F)cc2[nH]1 Homo sapiens CHEMBL3806691 cell-based format
CHEMBL4647620 OBDepict H 3 C O N H F F F O S HN O O N N IC50 = 1.8 nM 516.5 Cc1nc(-c2cc(C(F)(F)F)ccc2[C@H]2CCOc3cc(S(=O)(=O)Nc4ccncn4)ccc32)co1 Homo sapiens CHEMBL4629712 cell-based format
CHEMBL3950598 OBDepict Cl O F O NH 2 N F S NH O O N S N IC50 = 1.8 nM 535.94 Nc1noc2ccc(-c3cc(Cl)ccc3Oc3ccc(S(=O)(=O)Nc4ncns4)c(F)c3F)cc12 Homo sapiens CHEMBL3889237 cell-based format
CHEMBL3657955 OBDepict O N H S F O O CH 3 O F F F IC50 = 2.0 nM 395.37 CS(=O)(=O)NC(=O)c1cc(C2CC2)c(OCC2(C(F)(F)F)CC2)cc1F Homo sapiens CHEMBL3705617 assay format
CHEMBL4206499 OBDepict F H O H H 2 N Cl F S NH O O N S ClH IC50 = 2.0 nM 548.46 Cl.N[C@@H]1CCC=C(c2ccc(F)cc2)[C@H]1COc1cc(F)c(S(=O)(=O)Nc2nccs2)cc1Cl Homo sapiens CHEMBL4180114 cell-based format
CHEMBL4277472 OBDepict Cl Cl O O N NH S O O CH 3 IC50 = 2.0 nM 427.31 CS(=O)(=O)Nc1noc2cc(COc3ccc(Cl)c(Cl)c3)c(C3CC3)cc12 Homo sapiens CHEMBL4256578 cell-based format
CHEMBL3785356 OBDepict O S HN O N S O N F F F N H IC50 = 2.0 nM 522.57 O=S(=O)(Nc1ncns1)c1ccc2c(c1)OCCC2c1ccc(C(F)(F)F)cc1C1=CCNCC1 Homo sapiens CHEMBL3789454 cell-based format
CHEMBL3662081 OBDepict O HN S F N O O O F F F IC50 = 2.0 nM 464.48 O=C(NS(=O)(=O)N1CCC1)c1cc(C2CC2)c(OCC2(C(F)(F)F)CCCC2)cc1F Homo sapiens CHEMBL3707743 cell-based format
CHEMBL3662094 OBDepict O N H S N N O O O IC50 = 2.0 nM 445.59 O=C(NS(=O)(=O)N1CCC1)c1cnc(OCC23CC4CC(CC(C4)C2)C3)c(C2CC2)c1 Homo sapiens CHEMBL3707743 cell-based format
CHEMBL3657992 OBDepict F O N H O S O O IC50 = 2.0 nM 461.6 O=C(NS(=O)(=O)C1CCC1)c1cc(C2CC2)c(OCC23CC4CC(CC(C4)C2)C3)cc1F Homo sapiens CHEMBL3705617 assay format
CHEMBL4285790 OBDepict Cl O Cl N N N N H S O O CH 3 IC50 = 2.0 nM 427.31 CS(=O)(=O)Nc1nnc2cc(COc3cc(Cl)cc(Cl)c3)c(C3CC3)cn12 Homo sapiens CHEMBL4256582 cell-based format
CHEMBL3662177 OBDepict CH 3 O F N H O S O O IC50 = 2.0 nM 409.52 CC1CCCCC1COc1cc(F)c(C(=O)NS(=O)(=O)C2CC2)cc1C1CC1 Homo sapiens CHEMBL3707743 cell-based format
CHEMBL2325619 OBDepict N O S NH O O N S N N H 3 C N F F F H IC50 = 2.0 nM 506.49 Cc1[nH]ncc1-c1cc(C(F)(F)F)ccc1Oc1ccc(S(=O)(=O)Nc2ncns2)cc1C#N Homo sapiens CHEMBL4040125 cell-based format
CHEMBL3662192 OBDepict O HN S F O O CH 3 O IC50 = 2.0 nM 381.47 CS(=O)(=O)NC(=O)c1cc(C2CC2)c(OCC2CCC3CC3C2)cc1F Homo sapiens CHEMBL3707743 cell-based format
CHEMBL3662093 OBDepict F O N H O S N O O IC50 = 2.0 nM 422.52 O=C(NS(=O)(=O)N1CCC1)c1cc(C2CC2)c(OCC23CCCCC2C3)cc1F Homo sapiens CHEMBL3707743 cell-based format
CHEMBL3657942 OBDepict O HN S F O O CH 3 O IC50 = 2.0 nM 395.5 CS(=O)(=O)NC(=O)c1cc(C2CC2)c(OCC2CCC3(CC2)CC3)cc1F Homo sapiens CHEMBL3705617 assay format
CHEMBL3786756 OBDepict O S N H O N S O F HN F F F IC50 = 2.0 nM 513.54 O=S(=O)(Nc1nccs1)c1ccc2c(c1)OCCC2c1ccc(C(F)(F)F)cc1C1(F)CNC1 Homo sapiens CHEMBL3789454 cell-based format
CHEMBL4634870 OBDepict F N H F F F O S HN O O N N F IC50 = 2.1 nM 548.49 O=S(=O)(Nc1ncc(F)cn1)c1ccc2c(c1)OCC[C@@H]2c1ccc(C(F)(F)F)cc1-c1ccc(F)cn1 Homo sapiens CHEMBL4629712 cell-based format
CHEMBL3341984 OBDepict CH 3 O CH 3 N Cl O F N H O S N O O IC50 = 2.1 nM 483.95 CC(C)Oc1ncc(Oc2cc(F)c(C(=O)NS(=O)(=O)N3CCC3)cc2C2CC2)cc1Cl Homo sapiens CHEMBL3368016 single protein format
CHEMBL3657840 OBDepict H 3 C O S N H O O O F O IC50 = 2.2 nM 465.59 COCCS(=O)(=O)NC(=O)c1cc(C2CC2)c(OCC23CC4CC(CC(C4)C2)C3)cc1F Homo sapiens CHEMBL3707743 cell-based format
CHEMBL4639228 OBDepict H 3 C O N H F F F O S HN O O N S IC50 = 2.3 nM 521.54 Cc1nc(-c2cc(C(F)(F)F)ccc2[C@H]2CCOc3cc(S(=O)(=O)Nc4nccs4)ccc32)co1 Homo sapiens CHEMBL4629712 cell-based format
CHEMBL3940787 OBDepict H 3 C O N F O O N S F F F HN O O N N IC50 = 2.3 nM 591.54 COc1cc(-c2cccc(OC(F)(F)F)c2)c(F)cc1-n1c2c(ccc1=O)CN(S(=O)(=O)Nc1cccnn1)CC2 Homo sapiens CHEMBL3879709 cell-based format
CHEMBL4641925 OBDepict F N HN S O O O H N F F F O IC50 = 2.3 nM 537.54 O=S(=O)(Nc1cccc(F)n1)c1ccc2c(c1)OCC[C@@H]2c1ccc(C(F)(F)F)cc1N1CCOCC1 Homo sapiens CHEMBL4629712 cell-based format
CHEMBL3341987 OBDepict H 3 C O S F HN O O N N H H N CH 3 N IC50 = 2.6 nM 445.52 CCc1cc(S(=O)(=O)Nc2ccncn2)c(F)cc1O[C@H]1CCC[C@@H]1c1ccnn1C Homo sapiens CHEMBL3368019 cell-based format
CHEMBL3325527 OBDepict F O S F HN O O N S N H HN H F F IC50 = 2.6 nM 502.52 O=S(=O)(Nc1ncns1)c1cc(F)c(OC[C@H]2CNCC[C@@H]2c2ccc(F)c(F)c2)cc1F Homo sapiens CHEMBL3390669 cell-based format
CHEMBL4644542 OBDepict F N H F F F O S HN O O N N IC50 = 2.7 nM 530.5 O=S(=O)(Nc1ncccn1)c1ccc2c(c1)OCC[C@@H]2c1ccc(C(F)(F)F)cc1-c1ccc(F)cn1 Homo sapiens CHEMBL4629712 cell-based format
CHEMBL3921772 OBDepict H 3 C O N F O N F F F F S HN O O N N IC50 = 2.8 nM 593.53 COc1cc(-c2ccc(F)c(C(F)(F)F)c2)c(F)cc1-n1c2c(ccc1=O)CN(S(=O)(=O)Nc1cccnn1)CC2 Homo sapiens CHEMBL3879709 cell-based format
CHEMBL4644526 OBDepict F N H F F F O S HN O O N N F IC50 = 2.8 nM 548.49 O=S(=O)(Nc1ncc(F)cn1)c1ccc2c(c1)OCC[C@@H]2c1ccc(C(F)(F)F)cc1-c1ccc(F)nc1 Homo sapiens CHEMBL4629712 cell-based format
CHEMBL4569507 OBDepict F S HN O O N N O H N H H N F F F N Ki = 2.9 nM 538.53 O=S(=O)(Nc1ccncn1)c1cc2c(cc1F)[C@@H](N1CC[C@H](C(F)(F)F)C[C@@H]1c1ccnnc1)CCO2 Homo sapiens CHEMBL4386329 cell-based format
CHEMBL4450910 OBDepict F H N H H F F F O F S HN O O N N Ki = 2.9 nM 554.54 O=S(=O)(Nc1cccnn1)c1cc2c(cc1F)[C@@H](N1CC[C@H](C(F)(F)F)C[C@@H]1c1ccc(F)cc1)CCO2 Homo sapiens CHEMBL4386329 cell-based format
CHEMBL3658002 OBDepict F O N H O S N O O F F F IC50 = 3.0 nM 478.51 O=C(NS(=O)(=O)N1CCC1)c1cc(C2CC2)c(OCC2(C(F)(F)F)CCCCC2)cc1F Homo sapiens CHEMBL3707743 cell-based format
CHEMBL3657948 OBDepict O N H S F O O CH 3 CH 3 H 3 C O IC50 = 3.0 nM 463.62 CC(C)(C)S(=O)(=O)NC(=O)c1cc(C2CC2)c(OCC23CC4CC(CC(C4)C2)C3)cc1F Homo sapiens CHEMBL3705617 assay format
CHEMBL3658016 OBDepict F O N H O S N O O H 3 C IC50 = 3.0 nM 424.54 CC1(COc2cc(F)c(C(=O)NS(=O)(=O)N3CCC3)cc2C2CC2)CCCCC1 Homo sapiens CHEMBL3705617 assay format
CHEMBL4647267 OBDepict O S HN O N O N H N F F F O IC50 = 3.0 nM 520.53 O=S(=O)(Nc1ccncn1)c1ccc2c(c1)OCC[C@@H]2c1ccc(C(F)(F)F)cc1N1CCOCC1 Homo sapiens CHEMBL4629712 cell-based format
CHEMBL3657940 OBDepict O NH S F O O CH 3 O F IC50 = 3.0 nM 439.52 CS(=O)(=O)NC(=O)c1cc(C2CC2)c(OCC23CC4CC(CC(F)(C4)C2)C3)cc1F Homo sapiens CHEMBL3705617 assay format
CHEMBL3657854 OBDepict CH 3 HN S N H O O O F O IC50 = 3.0 nM 436.55 CNS(=O)(=O)NC(=O)c1cc(C2CC2)c(OCC23CC4CC(CC(C4)C2)C3)cc1F Homo sapiens CHEMBL3707743 cell-based format
CHEMBL3965477 OBDepict CH 3 O N O H 3 C Cl S HN O O N O IC50 = 3.0 nM 521.98 COc1cc(-c2cc(Cl)ccc2C)ccc1-n1c(=O)ccc2cc(S(=O)(=O)Nc3ccon3)ccc21 Homo sapiens CHEMBL3888194 cell-based format
CHEMBL3966841 OBDepict H 3 C O N Cl O CH 3 Cl S NH O O N N IC50 = 3.0 nM 567.45 COc1cc(-c2ccc(Cl)c(C)c2)c(Cl)cc1-n1c(=O)ccc2cc(S(=O)(=O)Nc3ccncn3)ccc21 Homo sapiens CHEMBL3888194 cell-based format
CHEMBL2325622 OBDepict H 3 C N N N O Cl F F S HN O O N S N IC50 = 3.0 nM 538.99 CN1CC(n2nccc2-c2cc(Cl)ccc2Oc2cc(F)c(S(=O)(=O)Nc3ncns3)cc2F)C1 Homo sapiens CHEMBL4040125 cell-based format
CHEMBL3805201 OBDepict F O S F NH O O N S N O NH 2 N IC50 = 3.0 nM 501.5 Nc1noc2ccc(-c3ccccc3Oc3cc(F)c(S(=O)(=O)Nc4ncns4)cc3F)cc12 Homo sapiens CHEMBL3806691 cell-based format
CHEMBL3662205 OBDepict H 3 C O F N H O S O O IC50 = 3.0 nM 409.52 CC1CCC(COc2cc(F)c(C(=O)NS(=O)(=O)C3CC3)cc2C2CC2)CC1 Homo sapiens CHEMBL3707743 cell-based format
CHEMBL3662193 OBDepict O N H S F O O O IC50 = 3.0 nM 407.51 O=C(NS(=O)(=O)C1CC1)c1cc(C2CC2)c(OCC2CCC3CC3C2)cc1F Homo sapiens CHEMBL3707743 cell-based format