Life beyond kinases: structure-based discovery of sorafenib as nanomolar antagonist of 5-HT receptors

X Lin, XP Huang, G Chen, R Whaley…

文献索引：Lin, Xingyu; Huang, Xi-Ping; Chen, Gang; Whaley, Ryan; Peng, Shiming; Wang, Yanli; Zhang, Guoliang; Wang, Simon X.; Wang, Shaohui; Roth, Bryan L.; Huang, Niu Journal of Medicinal Chemistry, 2012 , vol. 55, # 12 p. 5749 - 5759

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被引用次数: 37

摘要

Of great interest in recent years has been computationally predicting the novel polypharmacology of drug molecules. Here, we applied an “induced-fit” protocol to improve the homology models of 5-HT2A receptor, and we assessed the quality of these models in ...