8DI4

Discovery of MK-8189, a highly potent and selective PDE10A inhibitor for the treatment of schizophrenia

8DI4 の概要

• エントリーDOI: 10.2210/pdb8di4/pdb
• 分子名称: cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A, ZINC ION, MAGNESIUM ION, ... (5 entities in total)
• 機能のキーワード: pde10a, hydrolase, hydrolase-hydrolase inhibitor complex, hydrolase/hydrolase inhibitor
• 由来する生物種: Homo sapiens (human)
• タンパク質・核酸の鎖数: 2
• 化学式量合計: 80157.25

構造登録者

Hayes, R.P.,Yan, Y. (登録日: 2022-06-28, 公開日: 2023-02-08, 最終更新日: 2023-10-25)

• 主引用文献: Layton, M.E.,Kern, J.C.,Hartingh, T.J.,Shipe, W.D.,Raheem, I.,Kandebo, M.,Hayes, R.P.,Huszar, S.,Eddins, D.,Ma, B.,Fuerst, J.,Wollenberg, G.K.,Li, J.,Fritzen, J.,McGaughey, G.B.,Uslaner, J.M.,Smith, S.M.,Coleman, P.J.,Cox, C.D.; Discovery of MK-8189, a Highly Potent and Selective PDE10A Inhibitor for the Treatment of Schizophrenia.; J.Med.Chem., 66:1157-1171, 2023; PubMed: 36624931; DOI: 10.1021/acs.jmedchem.2c01521

実験手法

X-RAY DIFFRACTION (2.016 Å)