6K9U

Discovery of Pyrazolo[1,5-a]pyrimidine Derivative as a Highly Selective PDE10A Inhibitor

6K9U の概要

• エントリーDOI: 10.2210/pdb6k9u/pdb
• 分子名称: cAMP and cAMP-inhibited cGMP 3',5'-cyclic phosphodiesterase 10A, ZINC ION, MAGNESIUM ION, ... (6 entities in total)
• 機能のキーワード: enzyme, pde, bbb, brain penetration, crystatl structure, inhibitor, schizophrenia, hydrolase
• 由来する生物種: Rattus norvegicus (Rat)
• タンパク質・核酸の鎖数: 1
• 化学式量合計: 36543.61

構造登録者

Takedomi, K.,Koizumi, Y. (登録日: 2019-06-18, 公開日: 2019-07-17, 最終更新日: 2024-03-27)

• 主引用文献: Koizumi, Y.,Tanaka, Y.,Matsumura, T.,Kadoh, Y.,Miyoshi, H.,Hongu, M.,Takedomi, K.,Kotera, J.,Sasaki, T.,Taniguchi, H.,Watanabe, Y.,Takakuwa, M.,Kojima, K.,Baba, N.,Nakamura, I.,Kawanishi, E.; Discovery of a pyrazolo[1,5-a]pyrimidine derivative (MT-3014) as a highly selective PDE10A inhibitor via core structure transformation from the stilbene moiety.; Bioorg.Med.Chem., 27:3440-3450, 2019; PubMed: 31235264; DOI: 10.1016/j.bmc.2019.06.021

実験手法

X-RAY DIFFRACTION (2.35 Å)