3PTG

Design and Synthesis of a Novel, Orally Efficacious Tri-substituted Thiophene Based JNK Inhibitor

3PTG の概要

• エントリーDOI: 10.2210/pdb3ptg/pdb
• 分子名称: Mitogen-activated protein kinase 10, C-Jun-amino-terminal kinase-interacting protein 1, N-[4-methyl-3-(1H-1,2,4-triazol-5-yl)thiophen-2-yl]-2-(2-oxo-3,4-dihydroquinolin-1(2H)-yl)acetamide, ... (4 entities in total)
• 機能のキーワード: jnk inhibitor, thiophene, neurodegeneration, transferase-transferase inhibitor complex, transferase/transferase inhibitor
• 由来する生物種: Homo sapiens (human); 詳細
• 細胞内の位置: Cytoplasm: P53779; Cytoplasm (By similarity): Q9UQF2
• タンパク質・核酸の鎖数: 2
• 化学式量合計: 43583.48

構造登録者

Bowers, S.,Truong, A.P.,Neitz, J.,Neitzel, M.,Probst, G.D.,Hom, R.K.,Konradi, A.W.,Sham, H.L.,Toth, G.,Pan, H.,Yao, N.,Artis, D.R.,Brigham, E.F.,Quinn, K.P.,Sauer, J.,Powell, K.,Ruslim, L.,Bard, F.,Yednock, T.A.,Griswold-Prenner, I. (登録日: 2010-12-02, 公開日: 2011-03-02, 最終更新日: 2024-02-21)

• 主引用文献: Bowers, S.,Truong, A.P.,Neitz, R.J.,Neitzel, M.,Probst, G.D.,Hom, R.K.,Peterson, B.,Galemmo, R.A.,Konradi, A.W.,Sham, H.L.,Toth, G.,Pan, H.,Yao, N.,Artis, D.R.,Brigham, E.F.,Quinn, K.P.,Sauer, J.M.,Powell, K.,Ruslim, L.,Ren, Z.,Bard, F.,Yednock, T.A.,Griswold-Prenner, I.; Design and synthesis of a novel, orally active, brain penetrant, tri-substituted thiophene based JNK inhibitor.; Bioorg.Med.Chem.Lett., 21:1838-1843, 2011; PubMed: 21316234; DOI: 10.1016/j.bmcl.2011.01.046

実験手法

X-RAY DIFFRACTION (2.43 Å)