Design and Synthesis of New γ-Secretase Inhibitors
10.3870/j.issn.1672-0741.2009.06.016
- VernacularTitle:新型γ-分泌酶抑制剂的设计与合成
- Author:
Hao YAN
;
Juan LI
;
Jia YAN
;
Fengchao JIANG
- Publication Type:Journal Article
- Keywords:
pharmacophore model;
γ-secretase inhibitors;
virtual screening;
drug synthesis
- From:
Acta Medicinae Universitatis Scientiae et Technologiae Huazhong
2009;38(6):784-788
- CountryChina
- Language:Chinese
-
Abstract:
Objective By virtual screening in MDL,to search for a novel γ-secretase inhibitor.Methods A series of compounds were designed,synthesized,and evaluated based on pharmacophore model of γ-secretase inhibitors by virtual screening in MDL.Results The drug-likeness analytic data synthesized indicated that target compounds had drug-likeness.Each svnthesized compound was checked by IR spectroscopy,~1H and ~(13)C-NMR spectroscopy.Conclusion The designed compounds had better activity by model prediction.And the optimal compound showed a significant estimated activity value of 0.025 nmol/L and can be used as a lead for further drug development.
