Flexible scaffold-based cheminformatics approach for polypharmacological drug design
Zhangcheng Chen, Jing Yu, Huan Wang, Peiyu Xu, Luyu Fan, F X Sun, Sijie Huang, Pei Zhang, He Huang, Shuo Gu, Bowen Zhang, Yue Zhou, Xiaobo Wan, Gang Pei, H. Eric Xu, Jianjun Cheng, Sheng Wang
Topics & Concepts
Drug repositioningAgonistCheminformaticsVirtual screeningReceptorNeuroscienceScaffoldBiologyDrug discoveryPharmacologyDrugComputational biologyMedicineBioinformaticsBiomedical engineeringGeneticsComputational Drug Discovery MethodsReceptor Mechanisms and SignalingCholinesterase and Neurodegenerative Diseases