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P50406 | 5HT6R_HUMAN | 5-hydroxytryptamine receptor 6 (HTR6)

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
CHEMBL3329438 OBDepict Cl Cl S N O O N N H Ki = 0.04 nM 426.37 O=S(=O)(c1cccc(Cl)c1Cl)N1CCc2c(cccc2N2CCNCC2)C1 Homo sapiens CHEMBL3371192 cell-based format
CHEMBL3692995 OBDepict H 3 C O O S O O Cl N H Ki = 0.05 nM 377.85 COc1cc(S(=O)(=O)c2cccc(Cl)c2)cc2c3c(oc12)CCNC3 Homo sapiens CHEMBL3706364 assay format
CHEMBL3692882 OBDepict CH 3 O O S O O N H HN Ki = 0.083 nM 382.44 COc1cc(S(=O)(=O)c2ccc3[nH]ccc3c2)cc2c3c(oc12)CCNC3 Homo sapiens CHEMBL3706364 assay format
CHEMBL1083654 OBDepict H 3 C NH N N S N O O Ki = 0.088 nM 328.4 CNc1nn2c3c(cnc2c1S(=O)(=O)c1ccccc1)CCC3 Homo sapiens CHEMBL1118855 cell-based format
CHEMBL3692990 OBDepict H 3 C O O S O O S N H Ki = 0.1 nM 399.49 COc1cc(S(=O)(=O)c2csc3ccccc23)cc2c3c(oc12)CCNC3 Homo sapiens CHEMBL3706364 assay format
CHEMBL4852099 OBDepict F HN N H O N S O O Ki = 0.1 nM 467.57 O=S(=O)(c1ccccc1)n1ccc2c(OCCNCCNCc3ccc(F)cc3)cccc21 Homo sapiens CHEMBL4844509 cell membrane format
CHEMBL368209 OBDepict CH 3 N H 3 C N H HN S O O S CH 3 Cl Ki = 0.1 nM 448.01 Cc1c(S(=O)(=O)Nc2ccc3[nH]cc(CCN(C)C)c3c2)sc2ccc(Cl)cc12 Homo sapiens CHEMBL826384 cell-based format
CHEMBL3692993 OBDepict H 3 C O O S O O F Cl N H Ki = 0.11 nM 395.84 COc1cc(S(=O)(=O)c2cc(F)cc(Cl)c2)cc2c3c(oc12)CCNC3 Homo sapiens CHEMBL3706364 assay format
CHEMBL3692968 OBDepict CH 3 O O S O O O F F HN Ki = 0.11 nM 409.41 COc1cc(S(=O)(=O)c2cccc(OC(F)F)c2)cc2c3c(oc12)CCNC3 Homo sapiens CHEMBL3706364 assay format
CHEMBL3696966 OBDepict CH 3 O O S O O N H Ki = 0.11 nM 357.43 CCOc1cc(S(=O)(=O)c2ccccc2)cc2c3c(oc12)CCNC3 Homo sapiens CHEMBL3706364 assay format
CHEMBL1082763 OBDepict H 3 C NH N N S N O O Ki = 0.112 nM 342.42 CNc1nn2c3c(cnc2c1S(=O)(=O)c1ccccc1)CCCC3 Homo sapiens CHEMBL1118855 cell-based format
CHEMBL3692867 OBDepict H 3 C O O S O O N H Ki = 0.12 nM 343.4 COc1cc(S(=O)(=O)c2ccccc2)cc2c3c(oc12)CCNC3 Homo sapiens CHEMBL3706364 assay format
CHEMBL3692974 OBDepict H 3 C O O S O O F F F N H Ki = 0.13 nM 411.4 COc1cc(S(=O)(=O)c2cccc(C(F)(F)F)c2)cc2c3c(oc12)CCNC3 Homo sapiens CHEMBL3706364 assay format
CHEMBL3692910 OBDepict Cl O S O O N H HN Ki = 0.13 nM 386.86 O=S(=O)(c1ccc2[nH]ccc2c1)c1cc(Cl)c2oc3c(c2c1)CNCC3 Homo sapiens CHEMBL3706364 assay format
CHEMBL3692989 OBDepict H 3 C O O S O O S N H Ki = 0.16 nM 399.49 COc1cc(S(=O)(=O)c2ccc3sccc3c2)cc2c3c(oc12)CCNC3 Homo sapiens CHEMBL3706364 assay format
CHEMBL3692988 OBDepict H 3 C O O S O O N CH 3 N H Ki = 0.16 nM 396.47 COc1cc(S(=O)(=O)c2cn(C)c3ccccc23)cc2c3c(oc12)CCNC3 Homo sapiens CHEMBL3706364 assay format
CHEMBL3781299 OBDepict CH 3 O N S NH O O Br N CH 3 IC50 = 0.17 nM 518.48 COc1ccc(S(=O)(=O)NCCc2cccc3ccc(Br)cc23)cc1N1CCN(C)CC1 Homo sapiens CHEMBL3783931 cell-based format
CHEMBL3692863 OBDepict Cl O S O O N H 3 C N H Ki = 0.17 nM 400.89 Cn1cc(S(=O)(=O)c2cc(Cl)c3oc4c(c3c2)CNCC4)c2ccccc21 Homo sapiens CHEMBL3706364 assay format
CHEMBL3692997 OBDepict H 3 C O O S O O S N H Ki = 0.17 nM 349.43 COc1cc(S(=O)(=O)c2cccs2)cc2c3c(oc12)CCNC3 Homo sapiens CHEMBL3706364 assay format
CHEMBL3692971 OBDepict H 3 C O O S O O F N H Ki = 0.19 nM 361.39 COc1cc(S(=O)(=O)c2ccccc2F)cc2c3c(oc12)CCNC3 Homo sapiens CHEMBL3706364 assay format
CHEMBL3692975 OBDepict H 3 C O O S O O O F F F N H Ki = 0.19 nM 427.4 COc1cc(S(=O)(=O)c2cccc(OC(F)(F)F)c2)cc2c3c(oc12)CCNC3 Homo sapiens CHEMBL3706364 assay format
CHEMBL4170220 OBDepict F S O O H N H 3 C O H 2 N Ki = 0.2 nM 362.43 CN(C(N)=O)[C@@H]1CCCc2cc(S(=O)(=O)c3cccc(F)c3)ccc21 Homo sapiens CHEMBL4146403 single protein format
CHEMBL1668584 OBDepict CH 3 N H N N S N O O CH 3 H 3 C Ki = 0.2 nM 316.39 CNc1nn2c(C)cc(C)nc2c1S(=O)(=O)c1ccccc1 Homo sapiens CHEMBL1764143 single protein format
CHEMBL3692973 OBDepict H 3 C O O S O O F N H Ki = 0.2 nM 361.39 COc1cc(S(=O)(=O)c2cccc(F)c2)cc2c3c(oc12)CCNC3 Homo sapiens CHEMBL3706364 assay format
CHEMBL175835 OBDepict CH 3 N CH 3 N H HN S O O Cl Ki = 0.2 nM 427.96 CN(C)CCc1c[nH]c2ccc(NS(=O)(=O)c3ccc4c(Cl)cccc4c3)cc12 Homo sapiens CHEMBL826384 cell-based format
CHEMBL3692864 OBDepict Cl O S N O O N H Ki = 0.2 nM 386.86 O=S(=O)(c1cc(Cl)c2oc3c(c2c1)CNCC3)n1ccc2ccccc21 Homo sapiens CHEMBL3706364 assay format
CHEMBL2413982 OBDepict CH 3 N N O S O O Cl HN Ki = 0.2 nM 407.92 Cc1cc(N2CCNCC2)c2c(c1)N(S(=O)(=O)c1ccccc1Cl)CCO2 Homo sapiens CHEMBL2416141 cell-based format
CHEMBL3329430 OBDepict Cl Cl S O O N H N NH Ki = 0.2 nM 410.33 O=S(=O)(c1cc2cccc(N3CCNCC3)c2[nH]1)c1cccc(Cl)c1Cl Homo sapiens CHEMBL3371192 cell-based format
CHEMBL3329442 OBDepict H 3 C N H H O O S O O Ki = 0.2 nM 319.38 CNC[C@@H]1COc2ccc(S(=O)(=O)c3ccccc3)cc2O1 Homo sapiens CHEMBL3371192 cell-based format
CHEMBL3329451 OBDepict O N O N HN Ki = 0.2 nM 323.4 O=C1COc2c(N3CCNCC3)cccc2N1Cc1ccccc1 Homo sapiens CHEMBL3371192 cell-based format
CHEMBL1083075 OBDepict CH 3 N H N N S N O O H 3 C Ki = 0.202 nM 342.42 CNc1nn2c3c(c(C)nc2c1S(=O)(=O)c1ccccc1)CCC3 Homo sapiens CHEMBL1118855 cell-based format
CHEMBL3260311 OBDepict CH 3 N N S O O N Ki = 0.22 nM 367.47 CN1CCC(c2cccc3cc(S(=O)(=O)c4ccccn4)cnc23)CC1 Homo sapiens CHEMBL3268952 cell-based format
CHEMBL3692866 OBDepict CH 3 O S O O N H Ki = 0.22 nM 327.4 Cc1cc(S(=O)(=O)c2ccccc2)cc2c3c(oc12)CCNC3 Homo sapiens CHEMBL3706364 assay format
CHEMBL3696953 OBDepict CH 3 O S O O F F F N H Ki = 0.22 nM 395.4 Cc1cc(S(=O)(=O)c2cccc(C(F)(F)F)c2)cc2c3c(oc12)CCNC3 Homo sapiens CHEMBL3706364 assay format
CHEMBL1922635 OBDepict CH 3 N H N N S N O O Cl CH 3 H 3 C H 2 N IC50 = 0.227 nM 379.87 CNc1nn2c(C)c(CN)c(C)nc2c1S(=O)(=O)c1cccc(Cl)c1 Homo sapiens CHEMBL3705906 mitochondrion format
CHEMBL3696956 OBDepict CH 3 O S O O S N H Ki = 0.23 nM 383.49 Cc1cc(S(=O)(=O)c2ccc3sccc3c2)cc2c3c(oc12)CCNC3 Homo sapiens CHEMBL3706364 assay format
CHEMBL3692996 OBDepict H 3 C O O S O O Cl Cl N H Ki = 0.23 nM 412.29 COc1cc(S(=O)(=O)c2cc(Cl)cc(Cl)c2)cc2c3c(oc12)CCNC3 Homo sapiens CHEMBL3706364 assay format
CHEMBL1083390 OBDepict O S O N N N H Ki = 0.234 nM 353.45 O=S(=O)(c1ccccc1)c1cnc2c(N3CCNCC3)cccc2c1 Homo sapiens CHEMBL1118862 single protein format
CHEMBL1642864 OBDepict H N N S O O N HN ClH Ki = 0.24 nM 442.97 Cl.O=S(=O)(c1cccc2ccccc12)c1n[nH]c2ccc(CN3CCNCC3)cc12 Homo sapiens CHEMBL1647098 cell-based format
CHEMBL3187365 OBDepict Cl O N H 3 C Ki = 0.25 nM 285.77 CN1CC2c3ccccc3Oc3ccc(Cl)cc3C2C1 Homo sapiens CHEMBL3371192 cell-based format
CHEMBL3692901 OBDepict Cl O S O O NH Ki = 0.25 nM 361.85 O=S(=O)(c1ccccc1)c1cc(Cl)c2oc3c(c2c1)CCNCC3 Homo sapiens CHEMBL3706364 assay format
CHEMBL1082762 OBDepict CH 3 N H N N S N O O CH 3 Ki = 0.256 nM 356.45 CNc1nn2c(C)c3c(nc2c1S(=O)(=O)c1ccccc1)CCCC3 Homo sapiens CHEMBL1118855 cell-based format
CHEMBL3669650 OBDepict H 3 C N N CH 3 S O O N H Ki = 0.26 nM 405.52 CN1C2CCC1c1c(n(C)c3ccc(S(=O)(=O)c4ccc5[nH]ccc5c4)cc13)C2 Homo sapiens CHEMBL3705122 single protein format
CHEMBL3692942 OBDepict Cl O S O O S N H Ki = 0.26 nM 403.91 O=S(=O)(c1cc(Cl)c2oc3c(c2c1)CNCC3)c1csc2ccccc12 Homo sapiens CHEMBL3706364 assay format
CHEMBL3692992 OBDepict H 3 C O O S O O S N H Ki = 0.27 nM 349.43 COc1cc(S(=O)(=O)c2ccsc2)cc2c3c(oc12)CCNC3 Homo sapiens CHEMBL3706364 assay format
CHEMBL3781323 OBDepict CH 3 O N S NH O O F N CH 3 IC50 = 0.28 nM 457.57 COc1ccc(S(=O)(=O)NCCc2cccc3ccc(F)cc23)cc1N1CCN(C)CC1 Homo sapiens CHEMBL3783931 cell-based format
CHEMBL3693000 OBDepict Cl S O O CH 3 O N H Ki = 0.28 nM 361.85 Cc1cc(S(=O)(=O)c2cccc(Cl)c2)cc2c3c(oc12)CCNC3 Homo sapiens CHEMBL3706364 assay format
CHEMBL3692994 OBDepict H 3 C O O S O O Cl N H Ki = 0.28 nM 377.85 COc1cc(S(=O)(=O)c2ccc(Cl)cc2)cc2c3c(oc12)CCNC3 Homo sapiens CHEMBL3706364 assay format
CHEMBL3669657 OBDepict CH 3 N S CH 3 O O S N H Ki = 0.29 nM 422.58 Cc1cc(S(=O)(=O)c2csc3ccccc23)cc2c3c(n(C)c12)CC1CCC3N1 Homo sapiens CHEMBL3705122 single protein format
CHEMBL1922614 OBDepict CH 3 N H N N S N O O NH 2 H 3 C IC50 = 0.293 nM 317.37 CNc1nn2c(N)cc(C)nc2c1S(=O)(=O)c1ccccc1 Homo sapiens CHEMBL3705906 mitochondrion format
CHEMBL4169827 OBDepict O S N O N N HN Ki = 0.3 nM 342.42 O=S(=O)(c1ccccc1)n1ncc2c(N3CCNCC3)cccc21 Homo sapiens CHEMBL4146403 single protein format
CHEMBL4855991 OBDepict CH 3 HN O HN O N S O O Ki = 0.3 nM 463.56 CC(=O)Nc1ccc(CNCCOc2cccc3c2ccn3S(=O)(=O)c2ccccc2)cc1 Homo sapiens CHEMBL4831101 cell membrane format
CHEMBL193400 OBDepict Cl S N O O N Cl HN Ki = 0.3 nM 410.33 O=S(=O)(c1cccc(Cl)c1)n1ccc2c(N3CCNCC3)c(Cl)ccc21 Homo sapiens CHEMBL3371192 cell-based format
CHEMBL565723 OBDepict H 3 C NH N N S O O Cl Ki = 0.3 nM 349.84 CNCCn1cc(S(=O)(=O)c2cccc(Cl)c2)c2cccnc21 Homo sapiens CHEMBL1040173 cell-based format
CHEMBL353552 OBDepict H 3 C O S O N O O O N CH 3 H 3 C H 3 C H 3 C Ki = 0.3 nM 458.58 COc1ccc(OC)c(S(=O)(=O)n2c3c(c4cc(OC)ccc42)C(CN(C)C)CCC3)c1 Homo sapiens CHEMBL618238 cell-based format
CHEMBL179926 OBDepict H 3 C N CH 3 N H HN S O O S CH 3 Cl Ki = 0.3 nM 476.07 CCN(CC)CCc1c[nH]c2ccc(NS(=O)(=O)c3sc4ccc(Cl)cc4c3C)cc12 Homo sapiens CHEMBL826384 cell-based format
CHEMBL609994 OBDepict CH 3 N H N H HN S O O I Ki = 0.3 nM 495.39 CN1CCC[C@@H]1Cc1c[nH]c2ccc(NS(=O)(=O)c3ccc(I)cc3)cc12 Homo sapiens CHEMBL830434 cell-based format
CHEMBL3329453 OBDepict H N O N N HN Ki = 0.3 nM 308.39 O=c1[nH]c2c(N3CCNCC3)cccc2n1Cc1ccccc1 Homo sapiens CHEMBL3371192 cell-based format
CHEMBL96745 OBDepict H 3 C O N S N O O Br N H Ki = 0.3 nM 450.36 COc1ccc(S(=O)(=O)n2ccc3ccc(Br)cc32)cc1N1CCNCC1 Homo sapiens CHEMBL620800 single protein format
CHEMBL3696954 OBDepict F O F S O O CH 3 O HN Ki = 0.3 nM 393.41 Cc1cc(S(=O)(=O)c2cccc(OC(F)F)c2)cc2c3c(oc12)CCNC3 Homo sapiens CHEMBL3706364 assay format
CHEMBL187865 OBDepict OH O O OH CH 3 N H N S O O Ki = 0.3 nM 444.51 CN1CCC[C@@H]1Cc1cn(S(=O)(=O)c2ccccc2)c2ccccc12.O=C(O)C(=O)O Homo sapiens CHEMBL839441 cell-based format
CHEMBL3329452 OBDepict F N O O N F F F NH Ki = 0.3 nM 471.45 O=C1c2cccc(N3CCNCC3)c2Oc2ccc(F)cc2N1Cc1cccc(C(F)(F)F)c1 Homo sapiens CHEMBL3371192 cell-based format
CHEMBL3780579 OBDepict H 3 C O N S HN O O H 3 C H 3 C Br N H 3 C IC50 = 0.31 nM 546.53 COc1ccc(S(=O)(=O)NCC(C)(C)c2cccc3ccc(Br)cc23)cc1N1CCN(C)CC1 Homo sapiens CHEMBL3783931 cell-based format
CHEMBL3669661 OBDepict CH 3 O N S CH 3 O O N H N H Ki = 0.31 nM 421.52 COc1cc(S(=O)(=O)c2ccc3[nH]ccc3c2)cc2c3c(n(C)c12)CC1CCC3N1 Homo sapiens CHEMBL3705122 single protein format
CHEMBL3692969 OBDepict H 3 C O O S O O F F N H Ki = 0.32 nM 379.38 COc1cc(S(=O)(=O)c2ccc(F)c(F)c2)cc2c3c(oc12)CCNC3 Homo sapiens CHEMBL3706364 assay format
CHEMBL3692985 OBDepict H 3 C O O S O O HO F F F N H Ki = 0.32 nM 441.43 COc1cc(S(=O)(=O)c2cccc(C(O)C(F)(F)F)c2)cc2c3c(oc12)CCNC3 Homo sapiens CHEMBL3706364 assay format
CHEMBL1950775 OBDepict CH 3 N HN S O O N H Ki = 0.32 nM 391.5 Cn1c2c(c3cc(S(=O)(=O)c4ccc5[nH]ccc5c4)ccc31)C1CCC(C2)N1 Homo sapiens CHEMBL1952518 single protein format
CHEMBL1950776 OBDepict CH 3 N HN S O O S Ki = 0.33 nM 408.55 Cn1c2c(c3cc(S(=O)(=O)c4csc5ccccc45)ccc31)C1CCC(C2)N1 Homo sapiens CHEMBL1952518 single protein format
CHEMBL3669640 OBDepict H 3 C N NH S O O F N H Ki = 0.33 nM 409.49 Cn1c2c(c3cc(S(=O)(=O)c4cc(F)c5[nH]ccc5c4)ccc31)C1CCC(C2)N1 Homo sapiens CHEMBL3705122 single protein format
CHEMBL3692991 OBDepict H 3 C O O S O O F F N H Ki = 0.33 nM 379.38 COc1cc(S(=O)(=O)c2cc(F)cc(F)c2)cc2c3c(oc12)CCNC3 Homo sapiens CHEMBL3706364 assay format
CHEMBL3696967 OBDepict F O F O S O O N H Ki = 0.33 nM 379.38 O=S(=O)(c1ccccc1)c1cc(OC(F)F)c2oc3c(c2c1)CNCC3 Homo sapiens CHEMBL3706364 assay format
CHEMBL1668587 OBDepict H 3 C O N N H 3 C N N H S H 3 C O O IC50 = 0.34 nM 346.41 CNc1nn2c(COC)cc(C)nc2c1S(=O)(=O)c1ccccc1 Homo sapiens CHEMBL3705906 mitochondrion format
CHEMBL3260313 OBDepict CH 3 N N N S O O F Ki = 0.34 nM 385.46 CN1CCN(c2cccc3cc(S(=O)(=O)c4cccc(F)c4)cnc23)CC1 Homo sapiens CHEMBL3268952 cell-based format
CHEMBL3692984 OBDepict H 3 C O O S O O OH CH 3 H 3 C N H Ki = 0.35 nM 401.48 COc1cc(S(=O)(=O)c2cccc(C(C)(C)O)c2)cc2c3c(oc12)CCNC3 Homo sapiens CHEMBL3706364 assay format
CHEMBL3692894 OBDepict H 3 C N H O S Cl O O Ki = 0.35 nM 361.85 CC1NCCc2oc3c(Cl)cc(S(=O)(=O)c4ccccc4)cc3c21 Homo sapiens CHEMBL3706364 assay format
CHEMBL3692859 OBDepict Cl S O O Cl O N H Ki = 0.35 nM 382.27 O=S(=O)(c1cccc(Cl)c1)c1cc(Cl)c2oc3c(c2c1)CNCC3 Homo sapiens CHEMBL3706364 assay format
CHEMBL3692860 OBDepict F S O O Cl O N H Ki = 0.39 nM 365.81 O=S(=O)(c1cccc(F)c1)c1cc(Cl)c2oc3c(c2c1)CNCC3 Homo sapiens CHEMBL3706364 assay format
CHEMBL3692999 OBDepict F S O O CH 3 O N H Ki = 0.39 nM 345.39 Cc1cc(S(=O)(=O)c2ccccc2F)cc2c3c(oc12)CCNC3 Homo sapiens CHEMBL3706364 assay format
CHEMBL2172186 OBDepict H 3 C NH N N S N O O N H 3 C Ki = 0.39 nM 357.44 CNc1nn2c3c(cnc2c1S(=O)(=O)c1ccccc1)CN(C)CC3 Homo sapiens CHEMBL2176580 cell-based format
CHEMBL596199 OBDepict H N H NH HN S O O F F F Ki = 0.4 nM 423.46 O=S(=O)(Nc1ccc2[nH]cc(C[C@H]3CCCN3)c2c1)c1ccc(C(F)(F)F)cc1 Homo sapiens CHEMBL1071160 single protein format
CHEMBL3329441 OBDepict O S O O N N H Ki = 0.4 nM 358.46 O=S(=O)(c1ccccc1)c1ccc2c(c1)OCCC2N1CCNCC1 Homo sapiens CHEMBL3371192 cell-based format
CHEMBL4850738 OBDepict O S N O O N H N Ki = 0.4 nM 407.5 O=S(=O)(c1ccccc1)n1ccc2c(OCCNCc3ccccn3)cccc21 Homo sapiens CHEMBL4831101 cell membrane format
CHEMBL606559 OBDepict CH 3 N H N H HN S O O F F F Ki = 0.4 nM 437.49 CN1CCC[C@@H]1Cc1c[nH]c2ccc(NS(=O)(=O)c3ccc(C(F)(F)F)cc3)cc12 Homo sapiens CHEMBL830434 cell-based format
CHEMBL3409238 OBDepict O HN O N N N S O O Ki = 0.4 nM 558.7 O=C1CCc2ccc(OCCCCN3CCN(c4cccc5c4ccn5S(=O)(=O)c4ccccc4)CC3)cc2N1 Homo sapiens CHEMBL3413540 cell-based format
CHEMBL3639918 OBDepict CH 3 O O S O O O F F HN Ki = 0.4 nM 409.41 COc1cc(S(=O)(=O)c2ccc(OC(F)F)cc2)cc2c3c(oc12)CCNC3 Homo sapiens CHEMBL3706364 assay format
CHEMBL93240 OBDepict CH 3 S S N N H 3 C Ki = 0.4 nM 356.56 CSc1ccc2c(c1)C(N1CCN(C)CC1)Cc1ccccc1S2 Homo sapiens CHEMBL618118 single protein format
CHEMBL179408 OBDepict CH 3 N CH 3 N H HN S O O Ki = 0.4 nM 419.55 CN(C)CCc1c[nH]c2ccc(NS(=O)(=O)c3ccc(-c4ccccc4)cc3)cc12 Homo sapiens CHEMBL826384 cell-based format
CHEMBL3696962 OBDepict N O S O O N CH 3 N H Ki = 0.4 nM 391.45 Cn1cc(S(=O)(=O)c2cc(C#N)c3oc4c(c3c2)CNCC4)c2ccccc21 Homo sapiens CHEMBL3706364 assay format
CHEMBL362487 OBDepict Cl S N O O HN Ki = 0.4 nM 372.88 O=S(=O)(c1ccccc1Cl)n1cc(C2=CCNCC2)c2ccccc21 Homo sapiens CHEMBL829676 cell-based format
CHEMBL606556 OBDepict CH 3 N H N H HN S O O Cl Ki = 0.4 nM 403.94 CN1CCC[C@@H]1Cc1c[nH]c2ccc(NS(=O)(=O)c3cccc(Cl)c3)cc12 Homo sapiens CHEMBL830434 cell-based format
CHEMBL200795 OBDepict NH 2 S N O O N HN Ki = 0.4 nM 356.45 Nc1ccc(S(=O)(=O)n2ccc3c(N4CCNCC4)cccc32)cc1 Homo sapiens CHEMBL860114 cell-based format
CHEMBL3692986 OBDepict H 3 C O O S O O O N H Ki = 0.41 nM 413.5 COc1cc(S(=O)(=O)c2cccc(C3CCOC3)c2)cc2c3c(oc12)CCNC3 Homo sapiens CHEMBL3706364 assay format
CHEMBL3692856 OBDepict H 3 C N S O O O N H Ki = 0.42 nM 366.44 Cc1cn(S(=O)(=O)c2ccc3oc4c(c3c2)CNCC4)c2ccccc12 Homo sapiens CHEMBL3706364 assay format
CHEMBL4555868 OBDepict O S N O N H Ki = 0.43 nM 342.46 O=S(=O)(c1ccccc1)N1Cc2cccc(C3CCNCC3)c2C1 Homo sapiens CHEMBL4479921 cell-based format
CHEMBL1091919 OBDepict H 3 C S N N S N O O CH 3 Ki = 0.44 nM 373.5 CSc1nn2c3c(c(C)nc2c1S(=O)(=O)c1ccccc1)CCCC3 Homo sapiens CHEMBL1117029 cell-based format
CHEMBL1091206 OBDepict H 3 C S N N S N O O Ki = 0.458 nM 345.45 CSc1nn2c3c(cnc2c1S(=O)(=O)c1ccccc1)CCC3 Homo sapiens CHEMBL1117029 cell-based format
CHEMBL3781452 OBDepict CH 3 O N S NH O O F N CH 3 IC50 = 0.46 nM 457.57 COc1ccc(S(=O)(=O)NCCc2ccc(F)c3ccccc23)cc1N1CCN(C)CC1 Homo sapiens CHEMBL3783931 cell-based format
CHEMBL3669639 OBDepict H 3 C N NH S O O N F F F H Ki = 0.47 nM 459.49 Cn1c2c(c3cc(S(=O)(=O)c4cc(C(F)(F)F)c5[nH]ccc5c4)ccc31)C1CCC(C2)N1 Homo sapiens CHEMBL3705122 single protein format
CHEMBL3669655 OBDepict F N S CH 3 O O S N H Ki = 0.47 nM 426.54 Cn1c2c(c3cc(S(=O)(=O)c4csc5ccccc45)cc(F)c31)C1CCC(C2)N1 Homo sapiens CHEMBL3705122 single protein format
CHEMBL3692966 OBDepict H 3 C O O S O O O N H Ki = 0.48 nM 399.47 COc1cc(S(=O)(=O)c2ccc3c(c2)CCOC3)cc2c3c(oc12)CCNC3 Homo sapiens CHEMBL3706364 assay format