2NO3

Novel 4-anilinopyrimidines as potent JNK1 Inhibitors

2NO3 の概要

• エントリーDOI: 10.2210/pdb2no3/pdb
• 関連するPDBエントリー: 2g01 2gmx 2h96
• 分子名称: Mitogen-activated protein kinase 8, C-JUN-AMINO-TERMINAL KINASE-INTERACTING protein 1, SULFATE ION, ... (4 entities in total)
• 機能のキーワード: jnk1, c-jun n-terminal kinase, jnk1 inhibitors, anilinopyrimidines jnk1 inhibitors, signaling protein-inhibitor complex, signaling protein/inhibitor
• 由来する生物種: Homo sapiens (human); 詳細
• 細胞内の位置: Cytoplasm : P45983
• タンパク質・核酸の鎖数: 4
• 化学式量合計: 89557.26

構造登録者

Abad-Zapatero, C. (登録日: 2006-10-24, 公開日: 2007-04-17, 最終更新日: 2023-08-30)

主引用文献

Liu, M.,Wang, S.,Clampit, J.E.,Gum, R.J.,Haasch, D.L.,Rondinone, C.M.,Trevillyan, J.M.,Abad-Zapatero, C.,Fry, E.H.,Sham, H.L.,Liu, G.
Discovery of a new class of 4-anilinopyrimidines as potent c-Jun N-terminal kinase inhibitors: Synthesis and SAR studies.
Bioorg.Med.Chem.Lett., 17:668-672, 2007

PubMed Abstract: A new series of 4-anilinopyrimidines has been synthesized and evaluated as JNK1 inhibitors. SAR studies led to the discovery of potent JNK1 inhibitors with good enzymatic activity as well as cellular potency represented by compound 2b. Kinase selectivity profile and the crystal structure of 2b are also described.

PubMed: 17107797
DOI: 10.1016/j.bmcl.2006.10.093

実験手法

X-RAY DIFFRACTION (3.2 Å)