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Q04206 | TF65_HUMAN | Transcription factor p65 (RELA)

3D structures mapped by conservation among orthologs

[ Domain: "winged" // IRF ]

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[ Domain: "Immunoglobulin/Fibronectin type III/E set domains/PapD-like" // RHD_dimer ]

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[ Domain: "Common fold of diphtheria toxin/transcription factors/cytochrome f" // RHD_DNA_bind ]

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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
CHEMBL169 OBDepict HO O H H CH 3 H H 3 C CH 3 CH 3 H H 3 C H CH 3 CH 3 H OH IC50 = 31.0 nM 456.71 C[C@@H]1[C@H]2C3=CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]4(C)[C@]3(C)CC[C@@]2(C(=O)O)CC[C@H]1C Homo sapiens CHEMBL4235015 single protein format
CHEMBL939 OBDepict CH 3 O O N N HN N Cl O F IC50 = 55.0 nM 446.91 COc1cc2ncnc(Nc3ccc(F)c(Cl)c3)c2cc1OCCCN1CCOCC1 Homo sapiens CHEMBL4684706 cell-based format
CHEMBL438139 OBDepict CH 3 O O OH H H HO H O N O O CH 3 CH 3 H 3 C CH 3 IC50 = 80.0 nM 505.57 COc1ccc([C@@]23Oc4cc(OC)cc(OC)c4[C@]2(O)[C@H](O)[C@H](C(=O)N(C)C)[C@H]3c2ccccc2)cc1 Homo sapiens CHEMBL1100043 single protein format
CHEMBL4778826 OBDepict H 3 C O O H 3 C O N N H 3 C N Cl IC50 = 134.0 nM 383.83 COc1ccc(/C=C/C(=O)c2nnn(-c3ccc(Cl)cc3)c2C)cc1OC Homo sapiens CHEMBL4684706 cell-based format
CHEMBL218562 OBDepict CH 3 O F IC50 = 150.0 nM 228.27 COc1ccc(/C=C/c2ccccc2F)cc1 Homo sapiens CHEMBL3705677 single protein format
CHEMBL83880 OBDepict CH 3 N CH 3 IC50 = 150.0 nM 223.32 CN(C)c1ccc(/C=C/c2ccccc2)cc1 Homo sapiens CHEMBL3705677 single protein format
CHEMBL384590 OBDepict CH 3 S NH O O N H N H H 2 N IC50 = 230.0 nM 490.84 CCCCCCCCCCCCCCCCS(=O)(=O)NCCCNCCCCNCCCN Homo sapiens CHEMBL910807 cell-based format
CHEMBL1077979 OBDepict CH 3 O OH O O H HO H CH 3 H HO O IC50 = 250.0 nM 362.38 COc1cc(O)c2c(c1)/C=C/C[C@H](O)[C@H](O)C(=O)/C=CC[C@H](C)OC2=O Homo sapiens CHEMBL1804152 cell-based format
CHEMBL214521 OBDepict CH 3 O IC50 = 300.0 nM 224.3 CCOc1ccc(/C=C/c2ccccc2)cc1 Homo sapiens CHEMBL3705677 single protein format
CHEMBL218163 OBDepict CH 3 S NH O O N H N H H 2 N IC50 = 310.0 nM 406.68 CCCCCCCCCCS(=O)(=O)NCCCNCCCCNCCCN Homo sapiens CHEMBL910807 cell-based format
CHEMBL218434 OBDepict CH 3 S NH O O N H N H H 2 N IC50 = 340.0 nM 434.74 CCCCCCCCCCCCS(=O)(=O)NCCCNCCCCNCCCN Homo sapiens CHEMBL910807 cell-based format
CHEMBL215186 OBDepict CH 3 O OH OH IC50 = 500.0 nM 242.27 COc1ccc(/C=C/c2cccc(O)c2O)cc1 Homo sapiens CHEMBL3705677 single protein format
CHEMBL271669 OBDepict H 3 C S O O NH N IC50 = 600.0 nM 296.35 Cc1ccc2c(c1)-c1ccc3cccnc3c1NS2(=O)=O Homo sapiens CHEMBL945842 single protein format
CHEMBL215583 OBDepict CH 3 O O H 3 C IC50 = 600.0 nM 240.3 COc1ccc(/C=C/c2cccc(OC)c2)cc1 Homo sapiens CHEMBL3705677 single protein format
CHEMBL215432 OBDepict CH 3 O OH HO IC50 = 600.0 nM 242.27 COc1ccc(/C=C/c2ccc(O)c(O)c2)cc1 Homo sapiens CHEMBL3705677 single protein format
CHEMBL1801948 OBDepict OH OH O O H OH H H 3 C H HO O IC50 = 750.0 nM 348.35 C[C@H]1C/C=CC(=O)[C@@H](O)[C@@H](O)C/C=C/c2cc(O)cc(O)c2C(=O)O1 Homo sapiens CHEMBL1804152 cell-based format
CHEMBL214885 OBDepict CH 3 O CH 3 IC50 = 800.0 nM 224.3 COc1ccc(/C=C/c2cccc(C)c2)cc1 Homo sapiens CHEMBL3705677 single protein format
CHEMBL273149 OBDepict CH 3 O HN N S O O CH 3 H 3 C IC50 = 900.0 nM 340.4 COc1cc2ccc(C)nc2c2c1-c1cc(C)ccc1S(=O)(=O)N2 Homo sapiens CHEMBL945842 single protein format
CHEMBL383922 OBDepict CH 3 O H 3 C IC50 = 900.0 nM 224.3 COc1ccc(/C=C/c2ccc(C)cc2)cc1 Homo sapiens CHEMBL3705677 single protein format
CHEMBL402638 OBDepict H 3 C N HN S O O + N O _ O IC50 = 900.0 nM 343.36 Cc1ccc2cccc(NS(=O)(=O)c3cccc([N+](=O)[O-])c3)c2n1 Homo sapiens CHEMBL945842 single protein format
CHEMBL428064 OBDepict O S O NH N IC50 = 1000.0 nM 282.32 O=S1(=O)Nc2c(ccc3cccnc23)-c2ccccc21 Homo sapiens CHEMBL945842 single protein format
CHEMBL256403 OBDepict H 3 C N HN S O O S Cl IC50 = 1000.0 nM 338.84 Cc1ccc2cccc(NS(=O)(=O)c3ccc(Cl)s3)c2n1 Homo sapiens CHEMBL945842 single protein format
CHEMBL256061 OBDepict CH 3 O HN S N O O NH 2 H 3 C IC50 = 1000.0 nM 343.41 COc1cc(NS(=O)(=O)c2ccc(C)cc2N)c2ncccc2c1 Homo sapiens CHEMBL945842 single protein format
CHEMBL272552 OBDepict O S O NH N F F F IC50 = 1000.0 nM 350.32 O=S1(=O)Nc2c(ccc3cccnc23)-c2cc(C(F)(F)F)ccc21 Homo sapiens CHEMBL945842 single protein format
CHEMBL218615 OBDepict CH 3 O Cl IC50 = 1000.0 nM 244.72 COc1ccc(/C=C/c2cccc(Cl)c2)cc1 Homo sapiens CHEMBL3705677 single protein format
CHEMBL404128 OBDepict CH 3 O S O O HN N IC50 = 1000.0 nM 312.35 COc1ccc2c(c1)-c1ccc3cccnc3c1NS2(=O)=O Homo sapiens CHEMBL945842 single protein format
CHEMBL271233 OBDepict CH 3 O + N S O _ O NH O O N CH 3 IC50 = 1000.0 nM 373.39 COc1ccc(S(=O)(=O)Nc2cccc3ccc(C)nc23)c([N+](=O)[O-])c1 Homo sapiens CHEMBL945842 single protein format