Computational proteome-wide screening predicts neurotoxic drug-protein interactome for the investigational analgesic BIA 10-2474

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• 作者：Steven V. Molinski^a ; Vijay M. Shahani^a ; Stephen S. MacKinnon^a ; Leonard D. Morayniss^a ; Marcon Laforet^a ; Geoffrey Woollard^a ; Naheed Kurji^a ; Cecilia G. Sanchez^b ; Shoshana J. Wodak^a ; Andreas Windemuth^a ; ^{andreas.windemuth@cyclicarx.com}
• 关键词：BIA 10-2474 (PubChem CID ; 46831476) ; Proteome-docking ; Bioinformatics ; Neurotoxicity ; Drug-protein interactome ; In silico polypharmacology
• 刊名：Biochemical and Biophysical Research Communications
• 出版年：2017
• 出版时间：29 January 2017
• 年：2017
• 卷：483
• 期：1
• 页码：502-508
• 全文大小：1289 K
• 卷排序：483

文摘

Polypharmacology of FAAH inhibitor BIA 10-2474 evaluated by in silico proteome-wide screening. Identification of putative targets-of-action of BIA 10-2474 causing neurotoxicity. Inhibition of factor VII and thrombin predicted to cause intracranial hemorrhaging.