![]() ![]() In present study, the structure–activity relationships and binding mode of a series of anthraquinone derivatives were probed using three-dimensional quantitative structure–activity relationships (3D-QSAR), molecular docking, and molecular dynamics (MD) simulations. ![]() Recently, a series of inhibitors with various structures targeting PGAM1 have been reported, particularly anthraquinone derivatives. PGAM1 is overexpressed in a wide range of cancers, thereby promoting cancer cell proliferation and tumor growth, so it is gradually becoming an attractive target. 4State Key Laboratory of Quality Research in Chinese Medicine, Macau University of Science and Technology, Macau, China.Neher’s Biophysics Laboratory for Innovative Drug Discovery, Macau University of Science and Technology, Macau, China 2School of Pharmacy, Lanzhou University, Lanzhou, China.1College of Pharmacy, Shaanxi University of Chinese Medicine, Xianyang, China.Yuwei Wang 1*, Yifan Guo 1, Shaojia Qiang 2, Ruyi Jin 1, Zhi Li 1, Yuping Tang 1, Elaine Lai Han Leung 3,4, Hui Guo 1 * and Xiaojun Yao 3,4 * ![]()
0 Comments
Leave a Reply. |
AuthorWrite something about yourself. No need to be fancy, just an overview. ArchivesCategories |