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TitleSynthesis, SAR study, and biological evaluation of novel quinoline derivatives as phosphodiesterase 10A inhibitors with reduced CYP3A4 inhibition.
Journal, issue, pagesBioorg. Med. Chem., Vol. 23, Page 297-313, Year 2015
Publish dateOct 10, 2014 (structure data deposition date)
AuthorsHamaguchi, W. / Masuda, N. / Miyamoto, S. / Shiina, Y. / Kikuchi, S. / Mihara, T. / Moriguchi, H. / Fushiki, H. / Murakami, Y. / Amano, Y. ...Hamaguchi, W. / Masuda, N. / Miyamoto, S. / Shiina, Y. / Kikuchi, S. / Mihara, T. / Moriguchi, H. / Fushiki, H. / Murakami, Y. / Amano, Y. / Honbou, K. / Hattori, K.
External linksBioorg. Med. Chem. / PubMed:25515954
MethodsX-ray diffraction
Resolution3.13 Å
Structure data

PDB-4wn1:
Crystal structure of PDE10A in complex with 1-methyl-5-(1-methyl-3-{[4-(quinolin-2-yl)phenoxy]methyl}-1H-pyrazol-4-yl)pyridin-2(1H)-one
Method: X-RAY DIFFRACTION / Resolution: 3.13 Å

Chemicals

ChemComp-ZN:
Unknown entry

ChemComp-MG:
Unknown entry

ChemComp-3SJ:
1-methyl-5-(1-methyl-3-{[4-(quinolin-2-yl)phenoxy]methyl}-1H-pyrazol-4-yl)pyridin-2(1H)-one

ChemComp-HOH:
WATER

Source
  • homo sapiens (human)
KeywordsHYDROLASE/HYDROLASE INHIBITOR / Phosphodiesterase / Complex / Inhibitor / HYDROLASE-HYDROLASE INHIBITOR complex

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