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张学武

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期刊论文

Generation of predictive pharmacophore model for SARS-coronavirusmain proteinase

张学武XueWu Zhang *Yee LengYap Ralf M. Altmeyer

European Journal of Medicinal Chemistry 40(2005)57-62,-0001,():

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摘要/描述

Pharmacophore-based virtual screening is an effective, inexpensive and fast approach to discovering useful starting points for drug discovery.In this study, we developed a pharmacophore model for the main proteinase of severe acute respiratory syndrome coronavirus (SARSCoV).Then we used this pharmacophore model to search NCI 3D database including 250, 251 compounds and identified 30 existing drugscontaining the pharmacophore query. Among them are six compounds that already exhibited anti-SARS-CoV activity experimentally. Thismeans that our pharmacophore model can lead to the discovery of potent anti-SARS-CoV inhibitors or promising lead compounds for furtherSARS-CoV main proteinase inhibitor development.

【免责声明】以下全部内容由[张学武]上传于[2009年05月12日 10时34分21秒],版权归原创者所有。本文仅代表作者本人观点,与本网站无关。本网站对文中陈述、观点判断保持中立,不对所包含内容的准确性、可靠性或完整性提供任何明示或暗示的保证。请读者仅作参考,并请自行承担全部责任。

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