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Li Gao, Jian-Song Fang, Xiao-Yu Bai, Dan Zhou, Yi-Tao Wang, Ai-Lin Liu and Guan-Hua Du In silico Target Fishing for the Potential Targets and Molecular Mechanisms of Baicalein as an Antiparkinsonian Agent: Discovery of the Protective Effects on NMDA Receptor-Mediated Neurotoxicity Chemical Biology & Drug Design 81

Article first published online: 25 MAY 2013 | DOI: 10.1111/cbdd.12127

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In silico target fishing workflow of this article represents an efficient way to discover drug target. The two potential targets (COMT and MAO-B) of baicalein were found using this method. Although it was suggested that the protective role of baicalein on NMDA-induced neurotoxicity, the third ranked one (NMDAR) with relatively low consensus score might be not a target of baicalein from the [3H]MK-801 binding study.

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