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P62805 | H4_HUMAN | Histone H4 (H4-16)

3D structures mapped by conservation among orthologs

[ Domain: "Histone" // Histone_1 ]

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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

molecule_chembl_id structure assay_type relation values units mol_wt smiles organism assay_chembl_id bao_label
CHEMBL3930178 OBDepict H 3 C NH CH 3 N N N N N N H 3 C N N N F O IC50 = 1.0 nM 502.56 Cc1nnc2c(NC(C)C)nc(-c3nc4cnc(N5CCOCC5)cc4n3Cc3ccc(F)cn3)cn12 Homo sapiens CHEMBL3888060 assay format
CHEMBL3916639 OBDepict H 3 C NH N N N N N N H 3 C N N O IC50 = 3.0 nM 455.53 CNc1nc(-c2nc3ccc(N4CCOCC4)cc3n2Cc2ccccn2)cn2c(C)nnc12 Homo sapiens CHEMBL3888060 assay format
CHEMBL3953268 OBDepict H 3 C NH N N N N N N H 3 C N N N O IC50 = 3.0 nM 456.51 CNc1nc(-c2nc3cnc(N4CCOCC4)cc3n2Cc2ccccn2)cn2c(C)nnc12 Homo sapiens CHEMBL3888060 assay format
CHEMBL3959499 OBDepict H 3 C NH N N N N N N H 3 C N N N O IC50 = 4.0 nM 456.51 CNc1nc(-c2nc3cnc(N4CCOCC4)cc3n2Cc2cccnc2)cn2c(C)nnc12 Homo sapiens CHEMBL3888060 assay format
CHEMBL3979803 OBDepict H 3 C NH N N N N N N CH 3 H 3 C IC50 = 4.0 nM 409.5 CNc1nc(-c2nc(-c3ccccc3)c(C)n2Cc2ccccc2)cn2c(C)nnc12 Homo sapiens CHEMBL3888060 assay format
CHEMBL3935504 OBDepict H 3 C NH N N N N N N H 3 C N N O IC50 = 5.0 nM 455.53 CNc1nc(-c2nc3ccc(N4CCOCC4)cc3n2Cc2cccnc2)cn2c(C)nnc12 Homo sapiens CHEMBL3888060 assay format
CHEMBL3913643 OBDepict CH 3 N H N N N N N N H 3 C N N H CH 3 O IC50 = 5.0 nM 479.55 CNc1nc(-c2nc3cc(C4=NNC(=O)CC4C)ccc3n2Cc2ccccc2)cn2c(C)nnc12 Homo sapiens CHEMBL3888060 assay format
CHEMBL3939182 OBDepict H 3 C NH CH 3 N N N N N N H 3 C N N O IC50 = 5.0 nM 483.58 Cc1nnc2c(NC(C)C)nc(-c3nc4ccc(N5CCOCC5)cc4n3Cc3ccccn3)cn12 Homo sapiens CHEMBL3888060 assay format
CHEMBL3983932 OBDepict H 3 C N N H N N N N N N CH 3 IC50 = 7.0 nM 452.57 Cc1nnc2c(NC3CCN(C)CC3)nc(-c3nc4ccccc4n3Cc3ccccc3)cn12 Homo sapiens CHEMBL3888060 assay format
CHEMBL3920322 OBDepict H 3 C O N N H N N N N N N CH 3 N O IC50 = 7.0 nM 581.73 COCCN1CCC(Nc2nc(-c3nc4ccc(N5CCOCC5)cc4n3Cc3ccccc3)cn3c(C)nnc23)CC1 Homo sapiens CHEMBL3888060 assay format
CHEMBL3923899 OBDepict CH 3 HN CH 3 N N N N N N H 3 C N N CH 3 CH 3 IC50 = 7.0 nM 441.54 Cc1nnc2c(NC(C)C)nc(-c3nc4ccc(N(C)C)cc4n3Cc3ccccn3)cn12 Homo sapiens CHEMBL3888060 assay format
CHEMBL3929086 OBDepict CH 3 HN N N N N N N CH 3 N N N CH 3 IC50 = 8.0 nM 468.57 CNc1nc(-c2nc3ccc(N4CCN(C)CC4)cc3n2Cc2ccccn2)cn2c(C)nnc12 Homo sapiens CHEMBL3888060 assay format
CHEMBL3929450 OBDepict CH 3 NH N N N N N H 3 C N O H 3 C H 3 C IC50 = 8.0 nM 349.4 CNc1nc(-c2nn(C)c(C)c2Oc2ccccc2)cn2c(C)nnc12 Homo sapiens CHEMBL3888060 assay format
CHEMBL3927028 OBDepict CH 3 HN N N N N N N CH 3 N N N CH 3 IC50 = 8.0 nM 468.57 CNc1nc(-c2nc3ccc(N4CCN(C)CC4)cc3n2Cc2cccnc2)cn2c(C)nnc12 Homo sapiens CHEMBL3888060 assay format
CHEMBL3923105 OBDepict CH 3 O N N H N N N N N N H 3 C IC50 = 8.0 nM 496.62 COCCN1CCC(Nc2nc(-c3nc4ccccc4n3Cc3ccccc3)cn3c(C)nnc23)CC1 Homo sapiens CHEMBL3888060 assay format
CHEMBL4112988 OBDepict H 3 C NH CH 3 N N N N N N H 3 C N N N H CH 3 O IC50 = 9.0 nM 498.6 Cc1nnc2c(NC(C)C)nc(-c3nc4cnc(N5CCOC[C@H]5C)cc4n3Cc3ccccn3)cn12 Homo sapiens CHEMBL3888060 assay format
CHEMBL3970690 OBDepict CH 3 O N N H N N N N N N H 3 C F F IC50 = 9.0 nM 532.6 COCCN1CCC(Nc2nc(-c3nc4ccccc4n3Cc3ccc(F)c(F)c3)cn3c(C)nnc23)CC1 Homo sapiens CHEMBL3888060 assay format
CHEMBL3893231 OBDepict H 3 C NH CH 3 N N N N N N H 3 C N N N H CH 3 O IC50 = 9.0 nM 498.6 Cc1nnc2c(NC(C)C)nc(-c3nc4cnc(N5CCOC[C@@H]5C)cc4n3Cc3ccccn3)cn12 Homo sapiens CHEMBL3888060 assay format
CHEMBL3908717 OBDepict CH 3 HN N N N N N N CH 3 N N N CH 3 IC50 = 9.0 nM 468.57 CNc1nc(-c2nc3cnc(N4CCN(C)CC4)cc3n2Cc2ccccc2)cn2c(C)nnc12 Homo sapiens CHEMBL3888060 assay format
CHEMBL3951550 OBDepict CH 3 HN N N N N N N CH 3 N N N N CH 3 IC50 = 9.0 nM 469.56 CNc1nc(-c2nc3cnc(N4CCN(C)CC4)nc3n2Cc2ccccc2)cn2c(C)nnc12 Homo sapiens CHEMBL3888060 assay format
CHEMBL3919831 OBDepict CH 3 HN N N N N N N CH 3 N N CH 3 IC50 = 9.0 nM 467.58 CNc1nc(-c2nc3ccc(N4CCN(C)CC4)cc3n2Cc2ccccc2)cn2c(C)nnc12 Homo sapiens CHEMBL3888060 assay format
CHEMBL3941148 OBDepict CH 3 O N N H N N N N N N H 3 C F IC50 = 9.0 nM 514.61 COCCN1CCC(Nc2nc(-c3nc4ccccc4n3Cc3ccc(F)cc3)cn3c(C)nnc23)CC1 Homo sapiens CHEMBL3888060 assay format
CHEMBL3902208 OBDepict H 3 C NH CH 3 N N N N N N H 3 C N N N O IC50 = 10.0 nM 484.57 Cc1nnc2c(NC(C)C)nc(-c3nc4cnc(N5CCOCC5)cc4n3Cc3ccccn3)cn12 Homo sapiens CHEMBL3888060 assay format
CHEMBL3914807 OBDepict H 3 C NH N N N N N N H 3 C N O IC50 = 10.0 nM 454.54 CNc1nc(-c2nc3ccc(N4CCOCC4)cc3n2Cc2ccccc2)cn2c(C)nnc12 Homo sapiens CHEMBL3888060 assay format
CHEMBL3907651 OBDepict H 3 C N H N N N N N N CH 3 N O IC50 = 11.0 nM 454.54 CNc1nc(-c2nc3cc(C4CCOCC4)ccc3n2Cc2ccccn2)cn2c(C)nnc12 Homo sapiens CHEMBL3888060 assay format
CHEMBL3973914 OBDepict CH 3 HN N N N N N N CH 3 N N N N CH 3 IC50 = 12.0 nM 469.56 CNc1nc(-c2nc3cnc(N4CCN(C)CC4)cc3n2Cc2cccnc2)cn2c(C)nnc12 Homo sapiens CHEMBL3888060 assay format
CHEMBL3966649 OBDepict CH 3 HN N N N N N N CH 3 N N N N CH 3 IC50 = 12.0 nM 469.56 CNc1nc(-c2nc3cnc(N4CCN(C)CC4)cc3n2Cc2ccncc2)cn2c(C)nnc12 Homo sapiens CHEMBL3888060 assay format
CHEMBL3951605 OBDepict CH 3 HN CH 3 N N N N N N H 3 C N N N CH 3 CH 3 IC50 = 13.0 nM 442.53 Cc1nnc2c(NC(C)C)nc(-c3nc4cnc(N(C)C)cc4n3Cc3ccccn3)cn12 Homo sapiens CHEMBL3888060 assay format
CHEMBL3928047 OBDepict CH 3 HN N N N N N N CH 3 N N N N CH 3 IC50 = 13.0 nM 469.56 CNc1nc(-c2nc3cnc(N4CCN(C)CC4)cc3n2Cc2ccccn2)cn2c(C)nnc12 Homo sapiens CHEMBL3888060 assay format
CHEMBL4114198 OBDepict H 3 C N N N N N H N N H O N N N O IC50 = 13.0 nM 512.58 Cc1nnc2c(N[C@@H]3CCOC3)nc(-c3nc4cnc(N5CCOCC5)cc4n3Cc3cccnc3)cn12 Homo sapiens CHEMBL3888060 assay format
CHEMBL3919702 OBDepict H 3 C N N N N N N N CH 3 N H 3 C N IC50 = 14.0 nM 453.55 Cc1nc(-c2nc3cnc(N4CCN(C)CC4)cc3n2Cc2ccccc2)cn2c(C)nnc12 Homo sapiens CHEMBL3888060 assay format
CHEMBL3946335 OBDepict CH 3 HN CH 3 N N N N N N CH 3 N N IC50 = 14.0 nM 399.46 Cc1nnc2c(NC(C)C)nc(-c3nc4cnccc4n3Cc3ccccn3)cn12 Homo sapiens CHEMBL3888060 assay format
CHEMBL3916156 OBDepict CH 3 NH N N N N N N H 3 C H 3 C H 3 C IC50 = 15.0 nM 347.43 CNc1nc(-c2nc(C)c(C)n2Cc2ccccc2)cn2c(C)nnc12 Homo sapiens CHEMBL3888060 assay format
CHEMBL3937464 OBDepict CH 3 N H CH 3 N N N N N N H 3 C N H 3 C IC50 = 15.0 nM 412.5 Cc1ccc2nc(-c3cn4c(C)nnc4c(NC(C)C)n3)n(Cc3ccccn3)c2c1 Homo sapiens CHEMBL3888060 assay format
CHEMBL3914869 OBDepict CH 3 HN H 3 C N N N N N N CH 3 N N N CH 3 O IC50 = 17.0 nM 498.6 Cc1cccc(Cn2c(-c3cn4c(C)nnc4c(NC(C)C)n3)nc3cnc(N4CCOCC4)cc32)n1 Homo sapiens CHEMBL3888060 assay format
CHEMBL3956797 OBDepict H 3 C NH N N N N N N H 3 C N N N H 3 C IC50 = 17.0 nM 482.6 CCNc1nc(-c2nc3cnc(N4CCN(C)CC4)cc3n2Cc2ccccc2)cn2c(C)nnc12 Homo sapiens CHEMBL3888060 assay format
CHEMBL3947502 OBDepict CH 3 HN N N N N N N CH 3 N IC50 = 18.0 nM 370.42 CNc1nc(-c2nc3cccnc3n2Cc2ccccc2)cn2c(C)nnc12 Homo sapiens CHEMBL3888060 assay format
CHEMBL3891629 OBDepict CH 3 NH N N N N N H 3 C N H 3 C H 3 C IC50 = 18.0 nM 347.43 CNc1nc(-c2nn(C)c(C)c2Cc2ccccc2)cn2c(C)nnc12 Homo sapiens CHEMBL3888060 assay format
CHEMBL3956941 OBDepict CH 3 HN CH 3 N N N N N N H 3 C N N CH 3 CH 3 IC50 = 18.0 nM 441.54 Cc1nnc2c(NC(C)C)nc(-c3nc4cnc(C(C)C)cc4n3Cc3ccccn3)cn12 Homo sapiens CHEMBL3888060 assay format
CHEMBL4115491 OBDepict H 3 C N N N N N H N N H O N N N O IC50 = 20.0 nM 512.58 Cc1nnc2c(N[C@@H]3CCOC3)nc(-c3nc4cnc(N5CCOCC5)cc4n3Cc3ccccn3)cn12 Homo sapiens CHEMBL3888060 assay format
CHEMBL3960315 OBDepict CH 3 HN CH 3 N N N N N N CH 3 N IC50 = 20.0 nM 398.47 Cc1nnc2c(NC(C)C)nc(-c3nc4ccccc4n3Cc3ccccn3)cn12 Homo sapiens CHEMBL3888060 assay format
CHEMBL3946480 OBDepict CH 3 HN N N N N N N CH 3 IC50 = 22.0 nM 369.43 CNc1nc(-c2nc3ccccc3n2Cc2ccccc2)cn2c(C)nnc12 Homo sapiens CHEMBL3888060 assay format
CHEMBL3929241 OBDepict H 3 C N N N N N N N N H N H 3 C N CH 3 CH 3 IC50 = 26.0 nM 496.62 Cc1nnc2c(NC(C)C)nc(-c3nc4cnc(N5CCN(C)CC5)cc4n3Cc3ccccc3)cn12 Homo sapiens CHEMBL3888060 assay format
CHEMBL3909523 OBDepict CH 3 HN H 3 C N N N N N N CH 3 N N CH 3 IC50 = 28.0 nM 413.49 Cc1cc2c(cn1)nc(-c1cn3c(C)nnc3c(NC(C)C)n1)n2Cc1ccccn1 Homo sapiens CHEMBL3888060 assay format
CHEMBL4107079 OBDepict H 3 C N N N N N N NH N CH 3 N H O IC50 = 31.0 nM 441.5 Cc1cc2c(cn1)nc(-c1cn3c(C)nnc3c(N[C@@H]3CCOC3)n1)n2Cc1cccnc1 Homo sapiens CHEMBL3888060 assay format
CHEMBL3985926 OBDepict CH 3 N CH 3 N N N CH 3 N H 3 C N IC50 = 31.0 nM 332.41 Cc1nc(-c2cn3c(C)nnc3c(C)n2)n(Cc2ccccc2)c1C Homo sapiens CHEMBL3888060 assay format
CHEMBL3916033 OBDepict H 3 C NH CH 3 N N N N N N H 3 C N O IC50 = 32.0 nM 482.59 Cc1nnc2c(NC(C)C)nc(-c3nc4ccc(C5CCOCC5)cc4n3Cc3ccccn3)cn12 Homo sapiens CHEMBL3888060 assay format
CHEMBL3987136 OBDepict H 3 C NH CH 3 N N N N N N H 3 C N N O IC50 = 34.0 nM 483.58 Cc1nnc2c(NC(C)C)nc(-c3nc4cnc(C5CCOCC5)cc4n3Cc3ccccn3)cn12 Homo sapiens CHEMBL3888060 assay format
CHEMBL3959056 OBDepict CH 3 N H CH 3 N N N N N N H 3 C CH 3 H N N H CH 3 O IC50 = 38.0 nM 511.63 Cc1nnc2c(NC(C)C)nc(-c3nc4cnc(N5CCOC[C@@H]5C)cc4n3[C@@H](C)c3ccccc3)cn12 Homo sapiens CHEMBL3888060 assay format
CHEMBL3898582 OBDepict CH 3 O N N H N N N N N N H 3 C CH 3 H IC50 = 41.0 nM 510.65 COCCN1CCC(Nc2nc(-c3nc4ccccc4n3[C@@H](C)c3ccccc3)cn3c(C)nnc23)CC1 Homo sapiens CHEMBL3888060 assay format
CHEMBL3924063 OBDepict H 3 C N N O N N CH 3 N H 3 C N IC50 = 41.0 nM 320.36 Cc1nc(-c2cnn(C)c2Oc2ccccc2)cn2c(C)nnc12 Homo sapiens CHEMBL3888060 assay format
CHEMBL3951768 OBDepict CH 3 NH N N N N H 3 C N O N H 3 C IC50 = 41.0 nM 335.37 CNc1nc(-c2cnn(C)c2Oc2ccccc2)cn2c(C)nnc12 Homo sapiens CHEMBL3888060 assay format
CHEMBL3936354 OBDepict H 3 C O N N N N N HN N CH 3 N CH 3 CH 3 IC50 = 45.0 nM 428.5 COc1ccc2nc(-c3cn4c(C)nnc4c(NC(C)C)n3)n(Cc3ccccn3)c2c1 Homo sapiens CHEMBL3888060 assay format
CHEMBL4107020 OBDepict CH 3 O N N H N N N N N N H 3 C CH 3 H IC50 = 49.0 nM 510.65 COCCN1CCC(Nc2nc(-c3nc4ccccc4n3[C@H](C)c3ccccc3)cn3c(C)nnc23)CC1 Homo sapiens CHEMBL3888060 assay format
CHEMBL3961767 OBDepict CH 3 NH N N N N H 3 C N N H 3 C IC50 = 61.0 nM 333.4 CNc1nc(-c2cn(C)nc2Cc2ccccc2)cn2c(C)nnc12 Homo sapiens CHEMBL3888060 assay format
CHEMBL3972925 OBDepict CH 3 HN CH 3 N N N N N N CH 3 CH 3 H N N H 3 C H 3 C IC50 = 66.0 nM 455.57 Cc1nnc2c(NC(C)C)nc(-c3nc4cnc(C(C)C)cc4n3[C@@H](C)c3ccccn3)cn12 Homo sapiens CHEMBL3888060 assay format
CHEMBL3964764 OBDepict CH 3 N H CH 3 N N N N N N H 3 C CH 3 H N O IC50 = 69.0 nM 496.62 Cc1nnc2c(NC(C)C)nc(-c3nc4ccc(C5CCOCC5)cc4n3[C@@H](C)c3ccccn3)cn12 Homo sapiens CHEMBL3888060 assay format
CHEMBL3898305 OBDepict CH 3 N H CH 3 N N N N N N H 3 C CH 3 H N N N H CH 3 O IC50 = 74.0 nM 512.62 Cc1nnc2c(NC(C)C)nc(-c3nc4cnc(N5CCOC[C@@H]5C)cc4n3[C@@H](C)c3ccccn3)cn12 Homo sapiens CHEMBL3888060 assay format
CHEMBL3985602 OBDepict CH 3 O N N N N N N HN N H 3 C N CH 3 CH 3 IC50 = 126.0 nM 429.49 COc1cc2c(cn1)nc(-c1cn3c(C)nnc3c(NC(C)C)n1)n2Cc1ccccn1 Homo sapiens CHEMBL3888060 assay format
CHEMBL3949777 OBDepict CH 3 HN CH 3 N N N N N N CH 3 CH 3 H N H 3 C H 3 C IC50 = 243.0 nM 454.58 Cc1nnc2c(NC(C)C)nc(-c3nc4ccc(C(C)C)cc4n3[C@@H](C)c3ccccn3)cn12 Homo sapiens CHEMBL3888060 assay format