Identification of Novel Covalent XPO1 Inhibitors Based on a Hybrid Virtual Screening Strategy.

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第一作者： Zheyuan,Shen

第一单位： Department of Urology, Rui'an People's Hospital, the Third Affiliated Hospital of Wenzhou Medical University, Wenzhou 325200, China.

作者： Zheyuan,Shen ^[1] ; Weihao,Zhuang ^[2] ; Kang,Li ^[3] ; Yu,Guo ^[4] ; Bingxue,Qu ^[3] ; Sikang,Chen ^[3] ; Jian,Gao ^[2] ; Jing,Liu ^[3] ; Lei,Xu ^[2] ; Xiaowu,Dong ^[3] ; Jinxin,Che ^[3] ; Qimeng,Li ^[5]

作者单位： Department of Urology, Rui'an People's Hospital, the Third Affiliated Hospital of Wenzhou Medical University, Wenzhou 325200, China. ^[1] Innovation Institute for Artificial Intelligence in Medicine of Zhejiang University, Hangzhou 310018, China. ^[2] Hangzhou Institute of Innovative Medicine, Institute of Drug Discovery and Design, College of Pharmaceutical Sciences, Zhejiang University, Hangzhou 310058, China. ^[3] Jiangsu Hengrui Pharmaceuticals Co., Ltd., Shanghai 222000, China. ^[4] Institute of Bioinformatics and Medical Engineering, School of Electrical and Information Engineering, Jiangsu University of Technology, Changzhou 213001, China. ^[5]

关键词 anti-tumor covalent docking hybrid virtual screening nuclear export protein 1

主题词主动转运, 细胞核(Active Transport, Cell Nucleus);人类(Humans);核胞浆转运蛋白类(Karyopherins);肿瘤(Neoplasms);受体, 胞质和核(Receptors, Cytoplasmic and Nuclear)

DOI 10.3390/molecules27082543

PMID 35458742

发布时间 2022-07-16

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