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Q9UBN7 | HDAC6_HUMAN | Histone deacetylase 6 (HDAC6)

3D structures mapped by conservation among orthologs

[ Domain: "Arginase/deacetylase" // Hist_deacetyl ]

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[ Domain: "RING/U-box" // zf-UBP ]

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[ Domain: pdbs with more than 2 multi-domains ]

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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
CHEMBL511749 OBDepict OH N H O N H O N O N H O O H 3 C H 3 C CH 3 IC50 = 0.002 nM 446.5 CC(C)(C)OC(=O)Nc1ccc(-c2cc(C(=O)NCCCCCCC(=O)NO)no2)cc1 Homo sapiens CHEMBL976445 single protein format
CHEMBL4876454 OBDepict HO N H O N H O N O N H O O CH 3 CH 3 CH 3 IC50 = 0.002 nM 446.5 CC(C)(C)OC(=O)Nc1ccc(-c2cc(NC(=O)CCCCCCC(=O)NO)no2)cc1 Homo sapiens CHEMBL4842905 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 < 0.002 nM 446.5 CC(C)(C)OC(=O)Nc1cccc(-c2cc(C(=O)NCCCCCCC(=O)NO)no2)c1 Homo sapiens CHEMBL976445 single protein format
CHEMBL4082520 OBDepict HO N H O N N O O N O CH 3 Ki = 0.08 nM 510.55 CN1C(=O)C2CN(Cc3c2c2cc(OCc4ccccc4)ccc2n3Cc2ccc(C(=O)NO)cc2)C1=O Homo sapiens CHEMBL4048827 cell-based format
CHEMBL4290831 OBDepict OH HN O N H O N H N N N H O CH 3 ClH IC50 = 0.1 nM 527.03 CC(=O)Nc1ccc(-c2ccnc(Nc3ccc(NC(=O)CCCCCCC(=O)NO)cc3)n2)cc1.Cl Homo sapiens CHEMBL4268223 single protein format
CHEMBL99 OBDepict HO NH O CH 3 H 3 C H O N H 3 C CH 3 Ki = 0.13 nM 302.37 CC(/C=C/C(=O)NO)=C[C@@H](C)C(=O)c1ccc(N(C)C)cc1 Homo sapiens CHEMBL929249 single protein format
CHEMBL4098975 OBDepict OH N H O N H O N H N N N N N H IC50 = 0.14 nM 504.6 O=C(CCCCCCC(=O)Nc1ccc(NCCCn2cc(-c3ncnc4[nH]ccc34)cn2)cc1)NO Homo sapiens CHEMBL4031304 cell-based format
CHEMBL4100534 OBDepict H 3 C O N N O N H 3 C O NH O HO Ki = 0.15 nM 434.45 COc1ccc2c(c1)c1c(n2Cc2ccc(C(=O)NO)cc2)CN2CC1C(=O)N(C)C2=O Homo sapiens CHEMBL4048827 cell-based format
CHEMBL4101480 OBDepict HO N H O N N O N O CH 3 CH 3 Ki = 0.16 nM 420.47 COc1ccc2c(c1)c1c(n2Cc2ccc(C(=O)NO)cc2)CN2CC1C(=O)N(C)C2 Homo sapiens CHEMBL4048827 cell-based format
CHEMBL3912061 OBDepict HO N H O N N H S O O CH 3 IC50 = 0.17 nM 387.46 CS(=O)(=O)NCCc1cn(Cc2ccc(C(=O)NO)cc2)c2ccccc12 Homo sapiens CHEMBL3888198 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 < 0.17 nM 448.55 CC(C)(C)OC(=O)Nc1cccc(-c2csc(NC(=O)CCCCCC(=O)NO)n2)c1 Homo sapiens CHEMBL4401311 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 < 0.2 nM 462.57 CC(C)(C)OC(=O)Nc1cccc(-c2csc(NC(=O)CCCCCCC(=O)NO)n2)c1 Homo sapiens CHEMBL2424285 cell-based format
CHEMBL4243347 OBDepict OH N H O NH O N H N N N H N N H IC50 = 0.2 nM 462.51 O=C(CCCCCCC(=O)Nc1ccc(Nc2nc(-c3cn[nH]c3)c3cc[nH]c3n2)cc1)NO Homo sapiens CHEMBL4233425 single protein format
CHEMBL4074800 OBDepict OH HN O N N N O H 3 C Ki = 0.23 nM 390.44 CN1CN2Cc3c(c4ccccc4n3Cc3ccc(C(=O)NO)cc3)C(C2)C1=O Homo sapiens CHEMBL4048827 cell-based format
CHEMBL96051 OBDepict OH N H O N O O Ki = 0.25 nM 326.35 O=C(CCCCCN1C(=O)c2cccc3cccc(c23)C1=O)NO Homo sapiens CHEMBL1216987 single protein format
CHEMBL4247128 OBDepict H 2 C N N N N H N N H HN O NH O HO IC50 = 0.25 nM 516.61 C=CCCn1cc(-c2nc(Nc3ccc(NC(=O)CCCCCCC(=O)NO)cc3)nc3[nH]ccc23)cn1 Homo sapiens CHEMBL4233425 single protein format
CHEMBL4748025 OBDepict HO N H O N F N H H IC50 = 0.275 nM 301.32 O=C(NO)c1cnc(N[C@H](c2ccccc2)C2CC2)c(F)c1 Homo sapiens CHEMBL4715300 single protein format
CHEMBL4104117 OBDepict OH HN O NH N IC50 = 0.291 nM 293.33 O=C(NO)c1ccc(CNc2cccc3cccnc23)cc1 Homo sapiens CHEMBL4028190 cell-based format
CHEMBL4863515 OBDepict OH N H O N N N H IC50 = 0.3 nM 348.41 O=C(NO)c1ccc(CN2CCCc3cc(-c4cc[nH]n4)ccc32)cc1 Homo sapiens CHEMBL4823888 single protein format
CHEMBL4062190 OBDepict H 3 C O N N O N CH 3 O NH O HO Ki = 0.32 nM 434.45 COc1ccc2c3c(n(Cc4ccc(C(=O)NO)cc4)c2c1)CN1CC3C(=O)N(C)C1=O Homo sapiens CHEMBL4048827 cell-based format
CHEMBL3621294 OBDepict OH HN O NH O N H O N H IC50 = 0.323 nM 396.45 O=C(CCCCCCC(=O)Nc1ccc2c(c1)/C(=C/c1ccc[nH]1)C(=O)N2)NO Homo sapiens CHEMBL3626713 single protein format
CHEMBL4126811 OBDepict OH N H O HN O N O N H O O H 3 C H 3 C CH 3 IC50 = 0.33 nM 452.47 CC(C)(C)OC(=O)Nc1ccc(-c2cc(C(=O)NCc3ccc(C(=O)NO)cc3)no2)cc1 Homo sapiens CHEMBL4355674 cell-based format
CHEMBL4756236 OBDepict HO N H O N F N H H N IC50 = 0.351 nM 302.31 O=C(NO)c1cnc(N[C@@H](c2ccccn2)C2CC2)c(F)c1 Homo sapiens CHEMBL4715300 single protein format
CHEMBL4777296 OBDepict HO N N H O NH O NH 2 OH IC50 = 0.4 nM 386.45 NCc1ccc(NC(=O)N(CCCCO)Cc2ccc(C(=O)NO)cc2)cc1 Homo sapiens CHEMBL4729568 cell-based format
CHEMBL4092802 OBDepict OH N H O N N O N O HO CH 3 Ki = 0.42 nM 420.43 CN1C(=O)C2CN(Cc3c2c2cc(O)ccc2n3Cc2ccc(C(=O)NO)cc2)C1=O Homo sapiens CHEMBL4048827 cell-based format
CHEMBL4749714 OBDepict HO N H O N F NH F F IC50 = 0.425 nM 323.27 O=C(NO)c1cnc(NC2(c3c(F)cccc3F)CC2)c(F)c1 Homo sapiens CHEMBL4715300 single protein format
CHEMBL3670668 OBDepict SH HN O N H O N H O H 3 C IC50 = 0.44 nM 485.61 COc1ccc(-c2cc(-c3ccccc3)[nH]c2C(=O)NCc2ccc(C(=O)NCCS)cc2)cc1 Homo sapiens CHEMBL3707797 single protein format
CHEMBL4065283 OBDepict OH HN O N N S N O CH 3 Ki = 0.45 nM 420.49 CN1C(=O)C2CN(Cc3c2c2ccccc2n3Cc2ccc(C(=O)NO)cc2)C1=S Homo sapiens CHEMBL4048827 cell-based format
CHEMBL2018447 OBDepict HO NH O N N O H 2 N IC50 = 0.459 nM 392.46 NC(=O)CCN1CCc2c(c3ccccc3n2Cc2ccc(C(=O)NO)cc2)C1 Homo sapiens CHEMBL2020396 single protein format
CHEMBL4072045 OBDepict OH N H O N N O O N O H 3 C N O ClH Ki = 0.48 nM 570.05 CN1C(=O)C2CN(Cc3c2c2cc(OCCN4CCOCC4)ccc2n3Cc2ccc(C(=O)NO)cc2)C1=O.Cl Homo sapiens CHEMBL4048827 cell-based format
CHEMBL3759794 OBDepict OH N H O N H O N N IC50 = 0.5 nM 354.41 O=C(CCCCCC(=O)N/N=C/c1ccc(-c2cccnc2)cc1)NO Homo sapiens CHEMBL3762492 single protein format
CHEMBL4075722 OBDepict OH HN O N N O N CH 3 Ki = 0.51 nM 390.44 CN1CC2CN(Cc3c2c2ccccc2n3Cc2ccc(C(=O)NO)cc2)C1=O Homo sapiens CHEMBL4048827 cell-based format
CHEMBL2018446 OBDepict OH N H O N N N IC50 = 0.582 nM 412.49 O=C(NO)c1ccc(Cn2c3c(c4ccccc42)CN(Cc2ccncc2)CC3)cc1 Homo sapiens CHEMBL2020396 single protein format
CHEMBL4751524 OBDepict OH HN O N F N N IC50 = 0.595 nM 288.28 O=C(NO)c1cnc(N2CCc3ncccc3C2)c(F)c1 Homo sapiens CHEMBL4715300 single protein format
CHEMBL3759982 OBDepict OH N H O N H O N IC50 = 0.6 nM 353.42 O=C(CCCCCC(=O)N/N=C/c1ccc(-c2ccccc2)cc1)NO Homo sapiens CHEMBL3762492 single protein format
CHEMBL4777764 OBDepict HO N H O N F N H CH 3 H 3 C N IC50 = 0.601 nM 290.3 CC(C)(Nc1ncc(C(=O)NO)cc1F)c1ccccn1 Homo sapiens CHEMBL4715300 single protein format
CHEMBL4531853 OBDepict OH HN O N H O N O N IC50 = 0.61 nM 440.46 O=C(NO)c1ccc(CNC(=O)c2cc(Cn3c4ccccc4c4ccccc43)on2)cc1 Homo sapiens CHEMBL4329382 single protein format
CHEMBL4762877 OBDepict HO N H O N F N H CH 3 H 3 C IC50 = 0.639 nM 289.31 CC(C)(Nc1ncc(C(=O)NO)cc1F)c1ccccc1 Homo sapiens CHEMBL4715300 single protein format
CHEMBL4170617 OBDepict HO N H O N N S H 3 C CH 3 HN O N N IC50 = 0.64 nM 464.64 CC(C)CCN(CCCCCCC(=O)NO)c1ncc(C(=O)NCCCn2ccnc2)s1 Homo sapiens CHEMBL4144350 cell-based format
CHEMBL4160632 OBDepict OH N H O N O O N O IC50 = 0.65 nM 411.46 O=C(CCCCCN1C(=O)c2cccc3c(N4CCOCC4)ccc(c23)C1=O)NO Homo sapiens CHEMBL4141504 cell-based format
CHEMBL4087616 OBDepict OH N H O N N O N O CH 3 Ki = 0.7 nM 404.43 CN1C(=O)C2CN(Cc3c2c2ccccc2n3Cc2ccc(C(=O)NO)cc2)C1=O Homo sapiens CHEMBL4048827 cell-based format
CHEMBL4092880 OBDepict OH HN O N N H O N O CH 3 Ki = 0.7 nM 404.43 CN1C(=O)[C@@H]2CN(Cc3c2c2ccccc2n3Cc2ccc(C(=O)NO)cc2)C1=O Homo sapiens CHEMBL4048827 cell-based format
CHEMBL3670669 OBDepict H 3 C O N NH O H NH O N IC50 = 0.7 nM 502.57 COc1ccc(-c2cc(-c3ccccc3)[nH]c2C(=O)NCc2ccc(C(=O)Nc3ccccn3)cc2)cc1 Homo sapiens CHEMBL3707797 single protein format
CHEMBL4846435 OBDepict OH N H O N O NH 2 IC50 = 0.7 nM 325.37 NC(=O)c1ccc2c(c1)CCCN2Cc1ccc(C(=O)NO)cc1 Homo sapiens CHEMBL4823888 single protein format
CHEMBL2018301 OBDepict OH HN O N N Br CH 3 IC50 = 0.704 nM 414.3 CN1CCc2c(c3cc(Br)ccc3n2Cc2ccc(C(=O)NO)cc2)C1 Homo sapiens CHEMBL2020396 single protein format
CHEMBL4464421 OBDepict CH 3 O HN O N S N H O N H O HO IC50 = 0.79 nM 420.49 CCOC(=O)Nc1cccc(-c2csc(NC(=O)CCCCCC(=O)NO)n2)c1 Homo sapiens CHEMBL4401311 single protein format
CHEMBL4095667 OBDepict OH HN O NH N IC50 = 0.795 nM 293.33 O=C(NO)c1ccc(CNc2cccc3ncccc23)cc1 Homo sapiens CHEMBL4028190 cell-based format
CHEMBL2018448 OBDepict OH HN O N N O NH 2 IC50 = 0.799 nM 378.43 NC(=O)CN1CCc2c(c3ccccc3n2Cc2ccc(C(=O)NO)cc2)C1 Homo sapiens CHEMBL2020396 single protein format
CHEMBL4846714 OBDepict HO N H O N O Cl IC50 = 0.8 nM 344.8 O=C(NO)c1ccc(CN2C(=O)CCCc3cc(Cl)ccc32)cc1 Homo sapiens CHEMBL4823888 single protein format
CHEMBL4080014 OBDepict OH N H O F N CH 3 N IC50 = 0.8 nM 299.31 Cc1nc2ccccc2n1Cc1ccc(C(=O)NO)cc1F Homo sapiens CHEMBL4035206 single protein format
CHEMBL4282456 OBDepict OH HN O HN O N H N N N H O CH 3 ClH IC50 = 0.81 nM 527.03 CC(=O)Nc1ccc(-c2ccnc(Nc3cccc(NC(=O)CCCCCCC(=O)NO)c3)n2)cc1.Cl Homo sapiens CHEMBL4268223 single protein format
CHEMBL1631914 OBDepict HO N H O H O O HN O O H 3 C IC50 = 0.84 nM 454.52 COc1cc2cc(c1)COc1ccccc1NC(=O)[C@H](CCCCCC(=O)NO)OC/C=C2 Homo sapiens CHEMBL1634308 single protein format
CHEMBL4242626 OBDepict N N N N N H N N H NH O N H O HO IC50 = 0.85 nM 515.58 N#CCCn1cc(-c2nc(Nc3ccc(NC(=O)CCCCCCC(=O)NO)cc3)nc3[nH]ccc23)cn1 Homo sapiens CHEMBL4233425 single protein format
CHEMBL4177129 OBDepict OH N N H O HN O OH IC50 = 0.87 nM 357.41 O=C(NO)c1ccc(CN(CCCCO)C(=O)Nc2ccccc2)cc1 Homo sapiens CHEMBL4135539 cell-based format
CHEMBL2018452 OBDepict HO N H O N N IC50 = 0.872 nM 411.51 O=C(NO)c1ccc(Cn2c3c(c4ccccc42)CCN(Cc2ccccc2)C3)cc1 Homo sapiens CHEMBL2020396 single protein format
CHEMBL4083713 OBDepict HO NH O N N O N S CH 3 Ki = 0.88 nM 420.49 CN1C(=O)N2Cc3c(c4ccccc4n3Cc3ccc(C(=O)NO)cc3)C(C2)C1=S Homo sapiens CHEMBL4048827 cell-based format
CHEMBL4277484 OBDepict CH 3 N O O N N OH NH O HO IC50 = 0.89 nM 462.51 CCCN1CC(=O)N2Cc3c(c4cc(O)ccc4n3Cc3ccc(C(=O)NO)cc3)CC2C1=O Homo sapiens CHEMBL4271631 single protein format
CHEMBL4091233 OBDepict OH N H O N H O N N N N N H IC50 = 0.9 nM 489.58 O=C(CCCCCCC(=O)Nc1ccc(CCCn2cc(-c3ncnc4[nH]ccc34)cn2)cc1)NO Homo sapiens CHEMBL4031304 cell-based format
CHEMBL4857825 OBDepict OH N H O N O Br IC50 = 0.9 nM 375.22 O=C(NO)c1ccc(CN2C(=O)CCc3cc(Br)ccc32)cc1 Homo sapiens CHEMBL4823888 single protein format
CHEMBL4759584 OBDepict CH 3 N N H O HN O NH 2 OH IC50 = 0.9 nM 370.45 CCCCN(Cc1ccc(C(=O)NO)cc1)C(=O)Nc1ccc(CN)cc1 Homo sapiens CHEMBL4729568 cell-based format
CHEMBL4278715 OBDepict OH N H O NH N N H O O H 3 C O H 3 C CH 3 IC50 = 0.93 nM 498.54 COc1cc(-c2nc(NCc3ccc(C(=O)NO)cc3)cc3c2[nH]c2ccccc23)cc(OC)c1OC Homo sapiens CHEMBL4254163 single protein format
CHEMBL2018442 OBDepict H 2 C N N NH O HO IC50 = 0.972 nM 361.45 C=CCN1CCc2c(c3ccccc3n2Cc2ccc(C(=O)NO)cc2)C1 Homo sapiens CHEMBL2020396 single protein format
CHEMBL98 OBDepict OH NH O N H O Ki = 1.0 nM 264.32 O=C(CCCCCCC(=O)Nc1ccccc1)NO Homo sapiens CHEMBL929249 single protein format
CHEMBL4846606 OBDepict HO NH O F H N CH 3 IC50 = 1.0 nM 334.44 CN1CC2(CCCCC2)CC[C@H]1Cc1cc(F)cc(C(=O)NO)c1 Homo sapiens CHEMBL4828012 assay format
CHEMBL4847638 OBDepict OH N H O F N IC50 = 1.0 nM 246.24 O=C(NO)c1cc(F)c2c(c1)CCn1cccc1-2 Homo sapiens CHEMBL4828012 assay format
CHEMBL4856445 OBDepict HO N H O N N CH 3 IC50 = 1.0 nM 297.36 CN1Cc2cc(C(=O)NO)ccc2CN1Cc1ccccc1 Homo sapiens CHEMBL4828012 assay format
CHEMBL4862465 OBDepict OH N H O F N O IC50 = 1.0 nM 280.3 O=C(NO)c1ccc(CN2CC3(CCOC3)C2)c(F)c1 Homo sapiens CHEMBL4828012 assay format
CHEMBL4854340 OBDepict OH HN O F N N CH 3 IC50 = 1.0 nM 353.4 Cn1c2c(c3ccccc31)CCN(Cc1ccc(C(=O)NO)cc1F)C2 Homo sapiens CHEMBL4828012 assay format
CHEMBL4852905 OBDepict HO N H O F N IC50 = 1.0 nM 264.3 O=C(NO)c1cc(F)c2c(c1)CCN(C1CCC1)C2 Homo sapiens CHEMBL4828012 assay format
CHEMBL3655917 OBDepict OH N H O N N N H Cl IC50 = 1.0 nM 278.7 O=C(NO)c1cnc(NCc2cccc(Cl)c2)nc1 Homo sapiens CHEMBL3707895 single protein format
CHEMBL2048746 OBDepict OH HN O N S O O IC50 = 1.0 nM 342.38 O=C(/C=C/c1ccc2c(ccn2S(=O)(=O)c2ccccc2)c1)NO Homo sapiens CHEMBL2051701 single protein format
CHEMBL3356527 OBDepict HS NH H N H O O H O NH IC50 = 1.0 nM 377.51 O=C(Nc1ccccc1)[C@H](CCCCCS)NC(=O)[C@@H]1CCCNC1=O Homo sapiens CHEMBL3379481 single protein format
CHEMBL3356915 OBDepict HS NH H N H O O H O NH IC50 = 1.0 nM 377.51 O=C(Nc1ccccc1)[C@H](CCCCCS)NC(=O)[C@H]1CCCNC1=O Homo sapiens CHEMBL3379481 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 CHEMBL3379481 single protein format
CHEMBL3356918 OBDepict HS N H H N H O O H NH O IC50 = 1.0 nM 363.48 O=C1CC[C@@H](C(=O)N[C@@H](CCCCCS)C(=O)Nc2ccccc2)N1 Homo sapiens CHEMBL3379481 single protein format
CHEMBL3356922 OBDepict SH HN H N H O O H N H CH 3 O IC50 = 1.0 nM 377.51 Cc1cccc(NC(=O)[C@H](CCCCCS)NC(=O)[C@@H]2CCC(=O)N2)c1 Homo sapiens CHEMBL3379481 single protein format
CHEMBL3356924 OBDepict HS NH H N H O O H N H 3 C CH 3 O IC50 = 1.0 nM 391.54 Cc1cccc(NC(=O)[C@H](CCCCCS)NC(=O)[C@H]2CCC(=O)N2C)c1 Homo sapiens CHEMBL3379481 single protein format
CHEMBL3655993 OBDepict OH HN O N N HN F F IC50 = 1.0 nM 306.27 O=C(NO)c1cnc(NC2(c3c(F)cccc3F)CC2)nc1 Homo sapiens CHEMBL3707895 single protein format
CHEMBL4574641 OBDepict OH HN O N N N N H 2 N IC50 = 1.0 nM 310.32 Nc1ccc(-c2nnn(Cc3ccc(C(=O)NO)cc3)n2)cc1 Homo sapiens CHEMBL4416947 cell-based format
CHEMBL3655967 OBDepict OH HN O N N HN Cl IC50 = 1.0 nM 304.74 O=C(NO)c1cnc(NC2(c3ccccc3Cl)CC2)nc1 Homo sapiens CHEMBL3707895 single protein format
CHEMBL4225914 OBDepict OH N H O HN O N N H F IC50 = 1.0 nM 354.34 O=C(NO)c1ccc(CNC(=O)c2cc(-c3ccc(F)cc3)[nH]n2)cc1 Homo sapiens CHEMBL4221576 cell-based format
CHEMBL2153073 OBDepict OH N H O N O F O O CH 3 CH 3 IC50 < 1.0 nM 476.5 COc1ccc(/C=C(/C(=O)N2CCc3ccc(C(=O)NO)cc3C2)c2ccccc2F)cc1OC Homo sapiens CHEMBL2154199 single protein format
CHEMBL2153074 OBDepict OH N H O N O Cl IC50 < 1.0 nM 432.91 O=C(NO)c1ccc2c(c1)CN(C(=O)/C(=C/c1ccccc1)c1cccc(Cl)c1)CC2 Homo sapiens CHEMBL2154199 single protein format
CHEMBL2153079 OBDepict HO N H O N O CH 3 F IC50 < 1.0 nM 430.48 Cc1ccc(/C(=Cc2ccc(F)cc2)C(=O)N2CCc3ccc(C(=O)NO)cc3C2)cc1 Homo sapiens CHEMBL2154199 single protein format
CHEMBL2153075 OBDepict OH N H O N O CH 3 IC50 < 1.0 nM 412.49 Cc1ccc(/C(=Cc2ccccc2)C(=O)N2CCc3ccc(C(=O)NO)cc3C2)cc1 Homo sapiens CHEMBL2154199 single protein format
CHEMBL2153072 OBDepict HO N H O N O F O F H 3 C IC50 < 1.0 nM 464.47 COc1cc(/C=C(/C(=O)N2CCc3ccc(C(=O)NO)cc3C2)c2ccc(F)cc2)ccc1F Homo sapiens CHEMBL2154199 single protein format
CHEMBL2153071 OBDepict HO NH O N O F F F IC50 < 1.0 nM 452.43 O=C(NO)c1ccc2c(c1)CN(C(=O)/C(=C/c1ccc(F)cc1F)c1ccc(F)cc1)CC2 Homo sapiens CHEMBL2154199 single protein format
CHEMBL2153070 OBDepict OH N H O N O IC50 < 1.0 nM 398.46 O=C(NO)c1ccc2c(c1)CN(C(=O)/C(=C/c1ccccc1)c1ccccc1)CC2 Homo sapiens CHEMBL2154199 single protein format
CHEMBL2153078 OBDepict HO N H O N O O CH 3 IC50 < 1.0 nM 428.49 COc1ccc(/C=C(/C(=O)N2CCc3ccc(C(=O)NO)cc3C2)c2ccccc2)cc1 Homo sapiens CHEMBL2154199 single protein format
CHEMBL2153076 OBDepict HO N H O N O S F IC50 < 1.0 nM 422.48 O=C(NO)c1ccc2c(c1)CN(C(=O)/C(=C/c1cccs1)c1ccc(F)cc1)CC2 Homo sapiens CHEMBL2154199 single protein format
CHEMBL4095596 OBDepict OH N H O N CH 3 N N N N H IC50 = 1.0 nM 342.4 CC(CCCCCC(=O)NO)n1cc(-c2ncnc3[nH]ccc23)cn1 Homo sapiens CHEMBL4031304 cell-based format
CHEMBL2153077 OBDepict OH N H O N O O F CH 3 O CH 3 IC50 < 1.0 nM 476.5 COc1ccc(/C=C(/C(=O)N2CCc3ccc(C(=O)NO)cc3C2)c2ccc(F)cc2)c(OC)c1 Homo sapiens CHEMBL2154199 single protein format
CHEMBL2018300 OBDepict OH HN O N N Cl CH 3 IC50 = 1.02 nM 369.85 CN1CCc2c(c3cc(Cl)ccc3n2Cc2ccc(C(=O)NO)cc2)C1 Homo sapiens CHEMBL2020396 single protein format
CHEMBL4288953 OBDepict HO N H O HN N N H CH 3 IC50 = 1.1 nM 422.49 Cc1ccc(-c2nc(NCc3ccc(C(=O)NO)cc3)cc3c2[nH]c2ccccc23)cc1 Homo sapiens CHEMBL4254163 single protein format
CHEMBL4286867 OBDepict OH NH O N H O N N N H N O IC50 = 1.2 nM 518.62 O=C(CCCCCCC(=O)Nc1ccc(-c2ccnc(Nc3ccc(N4CCOCC4)cc3)n2)cc1)NO Homo sapiens CHEMBL4268223 single protein format
CHEMBL4292609 OBDepict CH 3 N O O N N O NH O HO IC50 = 1.25 nM 552.63 CCCN1CC(=O)N2Cc3c(c4cc(OCc5ccccc5)ccc4n3Cc3ccc(C(=O)NO)cc3)CC2C1=O Homo sapiens CHEMBL4271631 single protein format
CHEMBL4441675 OBDepict HO NH O N H 3 C N CH 3 CH 3 IC50 = 1.25 nM 323.4 Cc1c(CN(C)C)c2ccccc2n1-c1ccc(C(=O)NO)cc1 Homo sapiens CHEMBL4422763 cell-based format
CHEMBL519491 OBDepict OH N H O N H O N N N IC50 = 1.3 nM 407.47 O=C(CCCCCCC(=O)Nc1ccc(-c2cn(-c3ccccc3)nn2)cc1)NO Homo sapiens CHEMBL954940 single protein format
CHEMBL4290748 OBDepict OH HN O O N H N N N H O CH 3 ClH IC50 = 1.3 nM 485.97 CC(=O)Nc1ccc(-c2ccnc(Nc3ccc(OCCCCCC(=O)NO)cc3)n2)cc1.Cl Homo sapiens CHEMBL4268223 single protein format
CHEMBL4874875 OBDepict OH N H O N N IC50 = 1.3 nM 307.35 N#Cc1ccc2c(c1)CCCN2Cc1ccc(C(=O)NO)cc1 Homo sapiens CHEMBL4823888 single protein format