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TitleDiscovery of Orally Bioavailable Chromone Derivatives as Potent and Selective BRD4 Inhibitors: Scaffold Hopping, Optimization, and Pharmacological Evaluation.
Journal, issue, pagesJ. Med. Chem., Vol. 63, Page 5242-5256, Year 2020
Publish dateNov 5, 2019 (structure data deposition date)
AuthorsLiu, Z. / Chen, H. / Wang, P. / Li, Y. / Wold, E.A. / Leonard, P.G. / Joseph, S. / Brasier, A.R. / Tian, B. / Zhou, J.
External linksJ. Med. Chem. / PubMed:32255647
MethodsX-ray diffraction
Resolution2 Å
Structure data

PDB-6uwu:
Crystal Structure of the first bromodomain of human BRD4 in complex with the inhibitor ZL0516
Method: X-RAY DIFFRACTION / Resolution: 2 Å

Chemicals

ChemComp-EDO:
1,2-ETHANEDIOL

ChemComp-QKP:
2-{4-[(2R)-2-hydroxy-3-(4-methylpiperazin-1-yl)propoxy]-3,5-dimethylphenyl}-5,7-dimethoxy-4H-1-benzopyran-4-one

ChemComp-HOH:
WATER

Source
  • homo sapiens (human)
KeywordsTRANSCRIPTION / Bromodomain / Inhibitor / Complex / GENE REGULATION

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