5FP7

Crystal structure of human KDM4D in complex with 3-4-methylthiophen-2- yl methylaminopyridine-4-carboxylic acid

5FP7 の概要

• エントリーDOI: 10.2210/pdb5fp7/pdb
• 関連するPDBエントリー: 5FP3 5FP4 5FP8 5FP9 5FPA 5FPB
• 分子名称: LYSINE-SPECIFIC DEMETHYLASE 4D, ZINC ION, FE (II) ION, ... (7 entities in total)
• 機能のキーワード: inhibitor, lysine specific histone demethylase, jmjd2d, kdm4d, jumonji
• 由来する生物種: HOMO SAPIENS (HUMAN)
• タンパク質・核酸の鎖数: 1
• 化学式量合計: 39888.92

構造登録者

Chung, C. (登録日: 2015-11-27, 公開日: 2016-11-09, 最終更新日: 2024-05-08)

主引用文献

Westaway, S.M.,Preston, A.G.,Barker, M.D.,Brown, F.,Brown, J.A.,Campbell, M.,Chung, C.W.,Drewes, G.,Eagle, R.,Garton, N.,Gordon, L.,Haslam, C.,Hayhow, T.G.,Humphreys, P.G.,Joberty, G.,Katso, R.,Kruidenier, L.,Leveridge, M.,Pemberton, M.,Rioja, I.,Seal, G.A.,Shipley, T.,Singh, O.,Suckling, C.J.,Taylor, J.,Thomas, P.,Wilson, D.M.,Lee, K.,Prinjha, R.K.
Cell Penetrant Inhibitors of the KDM4 and KDM5 Families of Histone Lysine Demethylases. 2. Pyrido[3,4-d]pyrimidin-4(3H)-one Derivatives.
J. Med. Chem., 59:1370-1387, 2016

PubMed Abstract: Following the discovery of cell penetrant pyridine-4-carboxylate inhibitors of the KDM4 (JMJD2) and KDM5 (JARID1) families of histone lysine demethylases (e.g., 1), further optimization led to the identification of non-carboxylate inhibitors derived from pyrido[3,4-d]pyrimidin-4(3H)-one. A number of exemplars such as compound 41 possess interesting activity profiles in KDM4C and KDM5C biochemical and target-specific, cellular mechanistic assays.

PubMed: 26771203
DOI: 10.1021/acs.jmedchem.5b01538

実験手法

X-RAY DIFFRACTION (2 Å)