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Q969S8 | HDA10_HUMAN | Polyamine deacetylase HDAC10 (HDAC10)

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
CHEMBL2105763 OBDepict HO NH O N N N NH N CH 3 Ki = 0.05 nM 394.48 Cn1cc(CNCC2CCN(c3ncc(C(=O)NO)cn3)CC2)c2ccccc21 Homo sapiens CHEMBL3598921 single protein format
CHEMBL1796689 OBDepict HS H O O N H O H N H H 3 C CH 3 S N O CH 3 N S IC50 = 0.5 nM 496.68 CC(C)[C@H]1NC(=O)[C@]2(C)CSC(=N2)c2csc(n2)CNC(=O)C[C@@H](/C=C/CCS)OC1=O Homo sapiens CHEMBL3366348 single protein format
CHEMBL3593247 OBDepict HS H O O N H O H N H H 3 C CH 3 S N O CH 3 N S IC50 = 0.5 nM 496.68 CC(C)[C@@H]1NC(=O)[C@]2(C)CSC(=N2)c2csc(n2)CNC(=O)C[C@@H](/C=C/CCS)OC1=O Homo sapiens CHEMBL4021388 cell-based format
CHEMBL4532398 OBDepict HO N H O N N N N N O NH N O O H H 3 C IC50 = 0.58 nM 566.66 C[C@@H]1CN(C(=O)Nc2ccc(-c3nc(N4CCOCC4)c4cnn(CCCCCCC(=O)NO)c4n3)cc2)CCO1 Homo sapiens CHEMBL4413544 cell-based format
CHEMBL3827517 OBDepict HO N H O N N N CH 3 N N H 3 C N N N O N IC50 = 0.86 nM 476.5 CN(Cc1nc2c(N3CCOCC3)nc(-c3ccncc3)nc2n1C)c1ncc(C(=O)NO)cn1 Homo sapiens CHEMBL3829040 cell-based format
CHEMBL343448 OBDepict H 3 C N H O NH O H N H H S CH 3 CH 3 O O S O H HN H H 3 C H 3 C O IC50 = 0.9 nM 540.71 C/C=C1NC(=O)[C@H]2CSSCC/C=C/[C@H](CC(=O)N[C@H](C(C)C)C(=O)N2)OC(=O)[C@H](C(C)C)NC1=O Homo sapiens CHEMBL3366359 single protein format
CHEMBL3310505 OBDepict H 3 C N H O NH O H N H H S CH 3 CH 3 O O S O H HN H H 3 C H 3 C O IC50 = 1.0 nM 540.71 C/C=C1NC(=O)[C@H]2CSSCC/C=C/[C@@H](CC(=O)N[C@H](C(C)C)C(=O)N2)OC(=O)[C@H](C(C)C)NC1=O Homo sapiens CHEMBL4771399 single protein format
CHEMBL3356916 OBDepict SH N H H N H O O H HN H 3 C O IC50 = 1.0 nM 391.54 Cc1cccc(NC(=O)[C@H](CCCCCS)NC(=O)[C@@H]2CCCC(=O)N2)c1 Homo sapiens CHEMBL3379483 single protein format
CHEMBL4237803 OBDepict HO NH O N H NH O O O CH 3 Ki = 1.2 nM 347.37 COc1ccc(Nc2c(NCCCCCC(=O)NO)c(=O)c2=O)cc1 Homo sapiens CHEMBL4236293 single protein format
CHEMBL4552057 OBDepict HO N H O N N N N N O NH 2 IC50 = 1.43 nM 439.52 Nc1ccc(-c2nc(N3CCOCC3)c3cnn(CCCCCCC(=O)NO)c3n2)cc1 Homo sapiens CHEMBL4413544 cell-based format
CHEMBL4785064 OBDepict HO N H O N N N N N N O NH 2 IC50 = 1.7 nM 440.51 Nc1ccc(-c2nc(N3CCOCC3)c3ncn(CCCCCCC(=O)NO)c3n2)cn1 Homo sapiens CHEMBL4707193 cell-based format
CHEMBL2105763 OBDepict HO NH O N N N NH N CH 3 IC50 = 1.96 nM 394.48 Cn1cc(CNCC2CCN(c3ncc(C(=O)NO)cn3)CC2)c2ccccc21 Homo sapiens CHEMBL4376743 cell-based format
CHEMBL4460552 OBDepict HO NH O N H CH 3 H O N S N S IC50 = 1.98 nM 490.61 C[C@H](NC(=O)c1nc(-c2ncc(-c3ccccc3)s2)sc1C1CC1)c1ccc(C(=O)NO)cc1 Homo sapiens CHEMBL4357506 cell-based format
CHEMBL3356924 OBDepict HS NH H N H O O H N H 3 C CH 3 O IC50 = 2.0 nM 391.54 Cc1cccc(NC(=O)[C@H](CCCCCS)NC(=O)[C@H]2CCC(=O)N2C)c1 Homo sapiens CHEMBL3379483 single protein format
CHEMBL4464421 OBDepict CH 3 O HN O N S N H O N H O HO IC50 = 2.1 nM 420.49 CCOC(=O)Nc1cccc(-c2csc(NC(=O)CCCCCC(=O)NO)n2)c1 Homo sapiens CHEMBL4401313 single protein format
CHEMBL4744689 OBDepict HO N H O N N N N N N O NH 2 IC50 = 2.3 nM 440.51 Nc1ncc(-c2nc(N3CCOCC3)c3ccn(CCCCCCC(=O)NO)c3n2)cn1 Homo sapiens CHEMBL4707193 cell-based format
CHEMBL4749655 OBDepict OH N H O N N N N N O HO IC50 = 2.5 nM 454.53 O=C(CCCCCCn1cnc2c(N3CCOCC3)nc(-c3cccc(CO)c3)nc21)NO Homo sapiens CHEMBL4707193 cell-based format
CHEMBL3827814 OBDepict HO N H O N N N CH 3 N N H 3 C N N N O NH 2 IC50 = 2.8 nM 490.53 CN(Cc1nc2c(N3CCOCC3)nc(-c3ccc(N)cc3)nc2n1C)c1ncc(C(=O)NO)cn1 Homo sapiens CHEMBL3829040 cell-based format
CHEMBL3622533 OBDepict HO N H O N N N CH 3 S N N N N O O CH 3 IC50 = 2.8 nM 508.56 COc1ccc(-c2nc(N3CCOCC3)c3sc(CN(C)c4ncc(C(=O)NO)cn4)cc3n2)cn1 Homo sapiens CHEMBL3829040 cell-based format
CHEMBL3827894 OBDepict HO N H O N N N CH 3 N N H 3 C N N N O N N NH 2 IC50 = 2.83 nM 492.5 CN(Cc1nc2c(N3CCOCC3)nc(-c3cnc(N)nc3)nc2n1C)c1ncc(C(=O)NO)cn1 Homo sapiens CHEMBL3829040 cell-based format
CHEMBL2414098 OBDepict HO NH O N N H Br IC50 = 3.0 nM 340.22 O=C(CCCCCCc1nc2ccc(Br)cc2[nH]1)NO Homo sapiens CHEMBL2417247 single protein format
CHEMBL4241370 OBDepict HO N H O N H CH 3 H 3 C HN O O F F F Ki = 3.0 nM 413.4 CC(C)(CCCCC(=O)NO)Nc1c(Nc2ccc(C(F)(F)F)cc2)c(=O)c1=O Homo sapiens CHEMBL4236293 single protein format
CHEMBL4078721 OBDepict HS S H O O N H O H N H H 3 C CH 3 S N O CH 3 N S IC50 = 3.6 nM 556.8 CC(C)[C@@H]1NC(=O)[C@]2(C)CSC(=N2)c2csc(n2)CNC(=O)C[C@@H](/C=C/CCSCCS)OC1=O Homo sapiens CHEMBL4021388 cell-based format
CHEMBL1630208 OBDepict OH N H O NH O S N NH 2 IC50 = 3.7 nM 348.43 Nc1cccc(-c2csc(NC(=O)CCCCCC(=O)NO)n2)c1 Homo sapiens CHEMBL4401313 single protein format
CHEMBL146250 OBDepict SH H O O HN O H N H H CH 3 H 3 C H 3 C CH 3 O N H O NH H CH 3 SH O IC50 = 3.9 nM 542.72 C/C=C1NC(=O)[C@@H](CS)NC(=O)[C@@H](C(C)C)NC(=O)C[C@@H](/C=C/CCS)OC(=O)[C@H](C(C)C)NC1=O Homo sapiens CHEMBL3627137 single protein format
CHEMBL3356923 OBDepict SH HN H N H O O H N H CH 3 O IC50 = 4.0 nM 377.51 Cc1cccc(NC(=O)[C@H](CCCCCS)NC(=O)[C@H]2CCC(=O)N2)c1 Homo sapiens CHEMBL3379483 single protein format
CHEMBL3356917 OBDepict SH N H H N H O O H HN O H 3 C IC50 = 4.0 nM 391.54 Cc1ccc(NC(=O)[C@H](CCCCCS)NC(=O)[C@@H]2CCCC(=O)N2)cc1 Homo sapiens CHEMBL3379483 single protein format
CHEMBL483254 OBDepict OH NH O N H CH 3 N H IC50 = 4.0 nM 349.43 Cc1[nH]c2ccccc2c1CCNCc1ccc(/C=C/C(=O)NO)cc1 Homo sapiens CHEMBL3778490 single protein format
CHEMBL609583 OBDepict OH N H O N N N N S O O IC50 = 4.3 nM 413.46 O=C(NO)c1cnc(N2CCN(S(=O)(=O)c3ccc4ccccc4c3)CC2)nc1 Homo sapiens CHEMBL1068536 single protein format
CHEMBL3356925 OBDepict SH N H H N H O O H O N H H IC50 = 5.0 nM 439.58 O=C(Nc1ccccc1)[C@H](CCCCCS)NC(=O)[C@@H]1C(=O)NC[C@H]1c1ccccc1 Homo sapiens CHEMBL3379483 single protein format
CHEMBL99 OBDepict HO NH O CH 3 H 3 C H O N H 3 C CH 3 IC50 = 5.0 nM 302.37 CC(/C=C/C(=O)NO)=C[C@@H](C)C(=O)c1ccc(N(C)C)cc1 Homo sapiens CHEMBL954939 single protein format
CHEMBL3356922 OBDepict SH HN H N H O O H N H CH 3 O IC50 = 5.0 nM 377.51 Cc1cccc(NC(=O)[C@H](CCCCCS)NC(=O)[C@@H]2CCC(=O)N2)c1 Homo sapiens CHEMBL3379483 single protein format
CHEMBL4550526 OBDepict OH N H O N H O S N NH O O H 3 C CH 3 H 3 C IC50 = 5.7 nM 448.55 CC(C)(C)OC(=O)Nc1cccc(-c2csc(NC(=O)CCCCCC(=O)NO)n2)c1 Homo sapiens CHEMBL4401313 single protein format
CHEMBL1088736 OBDepict OH N H O N H O N N N HO HO IC50 = 5.8 nM 467.53 O=C(CCCCCCC(=O)Nc1cccc(-c2cn(-c3cc(CO)cc(CO)c3)nn2)c1)NO Homo sapiens CHEMBL1101060 single protein format
CHEMBL2417782 OBDepict OH HN O N H O S N NH O O H 3 C CH 3 H 3 C IC50 = 6.0 nM 462.57 CC(C)(C)OC(=O)Nc1cccc(-c2csc(NC(=O)CCCCCCC(=O)NO)n2)c1 Homo sapiens CHEMBL2424283 cell-based format
CHEMBL3356526 OBDepict SH N H H N H O O H N CH 3 O IC50 = 6.0 nM 391.54 CN1C(=O)CCC[C@H]1C(=O)N[C@@H](CCCCCS)C(=O)Nc1ccccc1 Homo sapiens CHEMBL3379483 single protein format
CHEMBL1094709 OBDepict OH N H O N H O N N N IC50 = 6.8 nM 407.47 O=C(CCCCCCC(=O)Nc1cccc(-n2cc(-c3ccccc3)nn2)c1)NO Homo sapiens CHEMBL1101060 single protein format
CHEMBL3828518 OBDepict HO N H O N N N CH 3 N N H 3 C N N N O O CH 3 IC50 = 6.85 nM 505.54 COc1ccc(-c2nc(N3CCOCC3)c3nc(CN(C)c4ncc(C(=O)NO)cn4)n(C)c3n2)cc1 Homo sapiens CHEMBL3829040 cell-based format
CHEMBL3353927 OBDepict SH N H H N H O O H HN O F F F IC50 = 7.0 nM 431.48 O=C1CC[C@H](C(=O)N[C@@H](CCCCCS)C(=O)Nc2cccc(C(F)(F)F)c2)N1 Homo sapiens CHEMBL3376043 single protein format
CHEMBL3356926 OBDepict SH N H H N H O O H O N H H IC50 = 7.0 nM 439.58 O=C(Nc1ccccc1)[C@H](CCCCCS)NC(=O)[C@H]1C(=O)NC[C@@H]1c1ccccc1 Homo sapiens CHEMBL3379483 single protein format
CHEMBL99 OBDepict HO NH O CH 3 H 3 C H O N H 3 C CH 3 Ki = 7.0 nM 302.37 CC(/C=C/C(=O)NO)=C[C@@H](C)C(=O)c1ccc(N(C)C)cc1 Homo sapiens CHEMBL1166735 single protein format
CHEMBL356066 OBDepict OH N N H NH O HO IC50 = 8.41 nM 379.46 O=C(/C=C/c1ccc(CN(CCO)CCc2c[nH]c3ccccc23)cc1)NO Homo sapiens CHEMBL1634309 single protein format
CHEMBL3356929 OBDepict SH N H H N H O O H N H O IC50 = 9.0 nM 349.46 O=C1C[C@@H](C(=O)N[C@@H](CCCCCS)C(=O)Nc2ccccc2)N1 Homo sapiens CHEMBL3379483 single protein format
CHEMBL3356527 OBDepict HS NH H N H O O H O NH IC50 = 9.0 nM 377.51 O=C(Nc1ccccc1)[C@H](CCCCCS)NC(=O)[C@@H]1CCCNC1=O Homo sapiens CHEMBL3379483 single protein format
CHEMBL1083086 OBDepict OH N H O HN HN O O Br Ki = 9.0 nM 372.22 O=C(CCCCCNC(=O)NC(=O)c1ccc(Br)cc1)NO Homo sapiens CHEMBL1119902 single protein format
CHEMBL1094707 OBDepict OH N H O N H O N N N IC50 = 9.8 nM 413.52 O=C(CCCCCCC(=O)Nc1cccc(-c2cn(C3CCCCC3)nn2)c1)NO Homo sapiens CHEMBL1101060 single protein format
CHEMBL257972 OBDepict HO O H N H H CH 3 O O NH H HN H O CH 3 CH 3 O N H H CH 3 HO Ki = 10.0 nM 530.62 CC(C)[C@H]1NC(=O)[C@@H](C)[C@@H](C/C=CCCC(=O)O)NC(=O)[C@@H](Cc2ccc(O)cc2)NC(=O)[C@@H](C)NC1=O Homo sapiens CHEMBL2423469 single protein format
CHEMBL3098602 OBDepict OH HN O N H H N H O O H HN O F F F IC50 = 10.6 nM 458.44 O=C(CCCCC[C@H](NC(=O)[C@H]1CCC(=O)N1)C(=O)Nc1cccc(C(F)(F)F)c1)NO Homo sapiens CHEMBL3102462 single protein format
CHEMBL1091475 OBDepict OH N H O NH O N N N I IC50 = 10.7 nM 533.37 O=C(CCCCCCC(=O)Nc1cccc(-c2cn(-c3ccc(I)cc3)nn2)c1)NO Homo sapiens CHEMBL1101060 single protein format
CHEMBL3356523 OBDepict HS N H H N H O O H N H O IC50 = 11.0 nM 377.51 O=C1CCC[C@@H](C(=O)N[C@@H](CCCCCS)C(=O)Nc2ccccc2)N1 Homo sapiens CHEMBL3379483 single protein format
CHEMBL3353925 OBDepict HS N H H N H O O H NH O IC50 = 11.0 nM 363.48 O=C1CC[C@H](C(=O)N[C@@H](CCCCCS)C(=O)Nc2ccccc2)N1 Homo sapiens CHEMBL3376043 single protein format
CHEMBL3356915 OBDepict HS NH H N H O O H O NH IC50 = 11.0 nM 377.51 O=C(Nc1ccccc1)[C@H](CCCCCS)NC(=O)[C@H]1CCCNC1=O Homo sapiens CHEMBL3379483 single protein format
CHEMBL3356919 OBDepict HS N H H N H O O H NH O IC50 = 11.0 nM 363.48 O=C1CC[C@@H](C(=O)N[C@H](CCCCCS)C(=O)Nc2ccccc2)N1 Homo sapiens CHEMBL3379483 single protein format
CHEMBL387924 OBDepict HO NH O N H O S N + N O _ O IC50 = 11.1 nM 392.44 O=C(CCCCCCC(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1)NO Homo sapiens CHEMBL889424 cell-based format
CHEMBL483893 OBDepict OH NH O NH O N N N HO Br IC50 = 13.0 nM 530.42 O=C(CCCCCCC(=O)Nc1cccc(-c2cn(CC(O)c3cccc(Br)c3)nn2)c1)NO Homo sapiens CHEMBL954939 single protein format
CHEMBL1830424 OBDepict CH 3 N N N H 3 C CH 3 N H O HO Ki = 13.0 nM 358.49 CCCCCCc1nc2cc(/C=C/C(=O)NO)ccc2n1CCN(C)C Homo sapiens CHEMBL1832529 single protein format
CHEMBL4781177 OBDepict OH HN O O H 3 C CH 3 N N N O O CH 3 CH 3 N CH 3 IC50 = 13.24 nM 537.66 COc1cc(OC)c2c(N3CCN(C)CC3)nc(-c3cc(C)c(OCCCCCC(=O)NO)c(C)c3)nc2c1 Homo sapiens CHEMBL4773585 cell-based format
CHEMBL3356928 OBDepict SH N H H N H O O H O N H H IC50 = 14.0 nM 439.58 O=C(Nc1ccccc1)[C@H](CCCCCS)NC(=O)[C@H]1C(=O)NC[C@H]1c1ccccc1 Homo sapiens CHEMBL3379483 single protein format
CHEMBL3356927 OBDepict SH N H H N H O O H O N H H IC50 = 14.0 nM 439.58 O=C(Nc1ccccc1)[C@H](CCCCCS)NC(=O)[C@@H]1C(=O)NC[C@@H]1c1ccccc1 Homo sapiens CHEMBL3379483 single protein format
CHEMBL1088734 OBDepict OH N H O N H O N N N F F F IC50 = 14.5 nM 475.47 O=C(CCCCCCC(=O)Nc1cccc(-c2cn(-c3ccc(C(F)(F)F)cc3)nn2)c1)NO Homo sapiens CHEMBL1101060 single protein format
CHEMBL3356918 OBDepict HS N H H N H O O H NH O IC50 = 15.0 nM 363.48 O=C1CC[C@@H](C(=O)N[C@@H](CCCCCS)C(=O)Nc2ccccc2)N1 Homo sapiens CHEMBL3379483 single protein format
CHEMBL487107 OBDepict OH HN O N H O N N N OH Br IC50 = 15.8 nM 530.42 O=C(CCCCCCC(=O)Nc1cccc(-c2cnnn2CC(O)c2cccc(Br)c2)c1)NO Homo sapiens CHEMBL954939 single protein format
CHEMBL1094710 OBDepict OH N H O N H O N N N IC50 = 16.6 nM 413.52 O=C(CCCCCCC(=O)Nc1cccc(-n2cc(C3CCCCC3)nn2)c1)NO Homo sapiens CHEMBL1101060 single protein format
CHEMBL468595 OBDepict HO N H O N H O N O NH 2 IC50 = 17.5 nM 346.39 Nc1cccc(-c2cc(C(=O)NCCCCCCC(=O)NO)no2)c1 Homo sapiens CHEMBL976446 single protein format
CHEMBL3827281 OBDepict HO N H O N N N CH 3 N N H 3 C N N N O N O CH 3 IC50 = 17.55 nM 506.53 COc1ccc(-c2nc(N3CCOCC3)c3nc(CN(C)c4ncc(C(=O)NO)cn4)n(C)c3n2)cn1 Homo sapiens CHEMBL3829040 cell-based format
CHEMBL487106 OBDepict OH HN O HN O N N N F IC50 = 17.6 nM 439.49 O=C(CCCCCCC(=O)Nc1cccc(-c2cnnn2Cc2ccc(F)cc2)c1)NO Homo sapiens CHEMBL954939 single protein format
CHEMBL1830536 OBDepict H 3 C N H N N CH 3 N H O OH Ki = 18.0 nM 356.47 CC/C=CCCc1nc2cc(/C=C/C(=O)NO)ccc2n1CCNCC Homo sapiens CHEMBL1832529 single protein format
CHEMBL483693 OBDepict OH N H O NH O N N N IC50 = 18.5 nM 421.5 O=C(CCCCCCC(=O)Nc1cccc(-c2cn(Cc3ccccc3)nn2)c1)NO Homo sapiens CHEMBL954939 single protein format
CHEMBL491316 OBDepict OH HN O N N N Ki = 18.9 nM 404.51 O=C(/C=C/c1ccc2c(c1)nc(CCc1ccccc1)n2CCN1CCCC1)NO Homo sapiens CHEMBL1016002 single protein format
CHEMBL4060201 OBDepict HO NH O N N N N N H IC50 = 19.0 nM 328.38 O=C(CCCCCCn1cc(-c2ncnc3[nH]ccc23)cn1)NO Homo sapiens CHEMBL4031326 single protein format
CHEMBL1830537 OBDepict H 3 C N N N H CH 3 H 3 C N H O HO Ki = 19.0 nM 358.49 CCCCCc1nc2cc(/C=C/C(=O)NO)ccc2n1CCNC(C)C Homo sapiens CHEMBL1832529 single protein format
CHEMBL488747 OBDepict OH HN O HN O N N N IC50 = 19.2 nM 421.5 O=C(CCCCCCC(=O)Nc1cccc(-c2cnnn2Cc2ccccc2)c1)NO Homo sapiens CHEMBL954939 single protein format
CHEMBL402363 OBDepict OH O H N H H H 3 C O O HN H NH H O H 3 C H 3 C O N H H H 3 C Ki = 20.0 nM 514.62 CC(C)[C@H]1NC(=O)[C@@H](C)[C@@H](C/C=CCCC(=O)O)NC(=O)[C@@H](Cc2ccccc2)NC(=O)[C@@H](C)NC1=O Homo sapiens CHEMBL2423469 single protein format
CHEMBL4099942 OBDepict HO NH O H O O N H O H N H H 3 C CH 3 S N O CH 3 N S IC50 = 21.0 nM 523.64 CC(C)[C@@H]1NC(=O)[C@]2(C)CSC(=N2)c2csc(n2)CNC(=O)C[C@@H](/C=C/CCC(=O)NO)OC1=O Homo sapiens CHEMBL4021388 cell-based format
CHEMBL3215861 OBDepict CH 3 N N N CH 3 CH 3 N H O HO ClH ClH Ki = 23.0 nM 431.41 CCCCc1nc2cc(/C=C/C(=O)NO)ccc2n1CCN(CC)CC.Cl.Cl Homo sapiens CHEMBL1832529 single protein format
CHEMBL489332 OBDepict HO NH O N N N Ki = 23.0 nM 418.54 O=C(/C=C/c1ccc2c(c1)nc(CCc1ccccc1)n2CCN1CCCCC1)NO Homo sapiens CHEMBL1832529 single protein format
CHEMBL460963 OBDepict HO NH O N N H 3 C H 3 C N H 3 C H 3 C Ki = 23.0 nM 420.56 CN(C)CC(C)(C)Cn1c(CCc2ccccc2)nc2cc(/C=C/C(=O)NO)ccc21 Homo sapiens CHEMBL1832529 single protein format
CHEMBL1851943 OBDepict H 3 C N N N H 3 C H 3 C N H O OH Ki = 23.0 nM 358.49 CCCCc1nc2cc(/C=C/C(=O)NO)ccc2n1CCN(CC)CC Homo sapiens CHEMBL3598921 single protein format
CHEMBL2103863 OBDepict HO N H O O N H O O N CH 3 CH 3 Ki = 24.0 nM 397.43 CN(C)Cc1c(C(=O)NCCOc2ccc(C(=O)NO)cc2)oc2ccccc12 Homo sapiens CHEMBL3598921 single protein format
CHEMBL520056 OBDepict HO NH O N H O N N N IC50 = 24.5 nM 407.47 O=C(CCCCCCC(=O)Nc1cccc(-c2cnnn2-c2ccccc2)c1)NO Homo sapiens CHEMBL954939 single protein format
CHEMBL3335299 OBDepict HO NH O N N N H IC50 = 25.0 nM 364.45 O=C(CCCCc1ccn(Cc2ccc(Nc3ccccc3)cc2)n1)NO Homo sapiens CHEMBL3388847 single protein format
CHEMBL598797 OBDepict OH HN O O O CH 3 N N H N CH IC50 = 26.1 nM 434.5 C#Cc1cccc(Nc2ncnc3cc(OC)c(OCCCCCCC(=O)NO)cc23)c1 Homo sapiens CHEMBL1065589 assay format
CHEMBL519668 OBDepict OH N H O N H O N N N IC50 = 27.7 nM 407.47 O=C(CCCCCCC(=O)Nc1cccc(-c2cn(-c3ccccc3)nn2)c1)NO Homo sapiens CHEMBL954939 single protein format
CHEMBL1830420 OBDepict CH 3 N N N H CH 3 N H O HO Ki = 28.0 nM 358.49 CCCCCCc1nc2cc(/C=C/C(=O)NO)ccc2n1CCNCC Homo sapiens CHEMBL1832529 single protein format
CHEMBL469274 OBDepict OH N H O N H O N O NH O O H 3 C CH 3 H 3 C IC50 = 28.2 nM 446.5 CC(C)(C)OC(=O)Nc1cccc(-c2cc(C(=O)NCCCCCCC(=O)NO)no2)c1 Homo sapiens CHEMBL976446 single protein format
CHEMBL389688 OBDepict OH HN O HN O HN O NH 2 H N H IC50 = 28.3 nM 541.65 N[C@@H](Cc1c[nH]c2ccccc12)C(=O)Nc1ccccc1-c1ccc(NC(=O)CCCCCCC(=O)NO)cc1 Homo sapiens CHEMBL889424 cell-based format
CHEMBL1830422 OBDepict CH 3 N N N H CH 3 CH 3 N H O HO Ki = 29.0 nM 372.51 CCCCCCc1nc2cc(/C=C/C(=O)NO)ccc2n1CCNC(C)C Homo sapiens CHEMBL1832529 single protein format
CHEMBL3335300 OBDepict HO NH O N N IC50 = 29.0 nM 349.43 O=C(CCCCc1ccn(Cc2ccc(-c3ccccc3)cc2)n1)NO Homo sapiens CHEMBL3388847 single protein format
CHEMBL3098604 OBDepict HO N H O HN H NH O O H N H H 3 C O IC50 = 30.3 nM 404.47 Cc1cccc(NC(=O)[C@H](CCCCCC(=O)NO)NC(=O)[C@H]2CCC(=O)N2)c1 Homo sapiens CHEMBL3102462 single protein format
CHEMBL483254 OBDepict OH NH O N H CH 3 N H Ki = 31.0 nM 349.43 Cc1[nH]c2ccccc2c1CCNCc1ccc(/C=C/C(=O)NO)cc1 Homo sapiens CHEMBL1832529 single protein format
CHEMBL4095596 OBDepict OH N H O N CH 3 N N N N H IC50 = 31.0 nM 342.4 CC(CCCCCC(=O)NO)n1cc(-c2ncnc3[nH]ccc23)cn1 Homo sapiens CHEMBL4031326 single protein format
CHEMBL3356524 OBDepict HS N H H N H O O H N H O IC50 = 32.0 nM 377.51 O=C1CCC[C@H](C(=O)N[C@@H](CCCCCS)C(=O)Nc2ccccc2)N1 Homo sapiens CHEMBL3379483 single protein format
CHEMBL1091474 OBDepict OH N H O NH O N N N F IC50 = 32.8 nM 425.46 O=C(CCCCCCC(=O)Nc1cccc(-c2cn(-c3ccc(F)cc3)nn2)c1)NO Homo sapiens CHEMBL1101060 single protein format
CHEMBL1830397 OBDepict OH HN O N N H 3 C H 3 C N CH 3 H 3 C CH 3 CH 3 H 3 C Ki = 34.0 nM 386.54 CN(C)CC(C)(C)Cn1c(CC(C)(C)C)nc2cc(/C=C/C(=O)NO)ccc21 Homo sapiens CHEMBL1832529 single protein format
CHEMBL1830396 OBDepict CH 3 N N N H CH 3 CH 3 N H O HO Ki = 34.0 nM 344.46 CCCCc1nc2cc(/C=C/C(=O)NO)ccc2n1CCNC(C)C Homo sapiens CHEMBL1832529 single protein format
CHEMBL483892 OBDepict HO N H O HN O N N N F IC50 = 34.3 nM 439.49 O=C(CCCCCCC(=O)Nc1cccc(-c2cn(Cc3ccc(F)cc3)nn2)c1)NO Homo sapiens CHEMBL954939 single protein format
CHEMBL3670669 OBDepict H 3 C O N NH O H NH O N IC50 = 35.0 nM 502.57 COc1ccc(-c2cc(-c3ccccc3)[nH]c2C(=O)NCc2ccc(C(=O)Nc3ccccn3)cc2)cc1 Homo sapiens CHEMBL3708001 single protein format
CHEMBL519491 OBDepict OH N H O N H O N N N IC50 = 36.1 nM 407.47 O=C(CCCCCCC(=O)Nc1ccc(-c2cn(-c3ccccc3)nn2)cc1)NO Homo sapiens CHEMBL954939 single protein format
CHEMBL3622729 OBDepict HS H O O HN O H NH CH 3 CH 3 S N O N H CH 3 O IC50 = 37.4 nM 480.61 C/C=C1NC(=O)c2csc(n2)CNC(=O)C[C@@H](/C=C/CCS)OC(=O)[C@H](C(C)C)NC1=O Homo sapiens CHEMBL3627137 single protein format
CHEMBL1083439 OBDepict OH N H O HN HN O O Ki = 40.0 nM 293.32 O=C(CCCCCNC(=O)NC(=O)c1ccccc1)NO Homo sapiens CHEMBL1119902 single protein format