6M9L

Structure-based Design, Synthesis, and Biological Evaluation of Imidazo[4,5-b]pyridine-2-one based p38 MAP Kinase Inhibitors by scaffold hopping - compound 10

6M9L の概要

• エントリーDOI: 10.2210/pdb6m9l/pdb
• 分子名称: Mitogen-activated protein kinase 14, 3-benzyl-6-[(2,4-difluorophenyl)amino]-1,3-dihydro-2H-imidazo[4,5-b]pyridin-2-one (3 entities in total)
• 機能のキーワード: sbdd, structure based drug design, p38, kinase, transferase, transferase-inhibitor complex, transferase/inhibitor
• 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: 45057.08

構造登録者

Lane, W.,Okada, K. (登録日: 2018-08-23, 公開日: 2019-04-17, 最終更新日: 2024-03-13)

• 主引用文献: Kaieda, A.,Takahashi, M.,Fukuda, H.,Okamoto, R.,Morimoto, S.,Gotoh, M.,Miyazaki, T.,Hori, Y.,Unno, S.,Kawamoto, T.,Tanaka, T.,Itono, S.,Takagi, T.,Sugimoto, H.,Okada, K.,Snell, G.,Bertsch, R.,Nguyen, J.,Sang, B.C.,Miwatashi, S.; Structure-Based Design, Synthesis, and Biological Evaluation of Imidazo[4,5-b]pyridin-2-one-Based p38 MAP Kinase Inhibitors: Part 1.; Chemmedchem, 14:1022-1030, 2019; PubMed: 30945818; DOI: 10.1002/cmdc.201900129

実験手法

X-RAY DIFFRACTION (2.45 Å)