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3D-QSAR, molecular docking, and molecular dynamics simulation study of thieno[3,2-b]pyrrole-5-carboxamide derivatives as LSD1 inhibitors
Histone Lysine Specific Demethylase 1 (LSD1) is overexpressed in many cancers and becomes a new target for anticancer drugs. In recent years, small molecule inhibitors with various structures targeting LSD1 have been reported. Here we report the binding interaction modes of a series of thieno[3,2-b]...
Autores principales: | Xu, Yongtao, He, Zihao, Liu, Hongyi, Chen, Yifan, Gao, Yunlong, Zhang, Songjie, Wang, Meiting, Lu, Xiaoyuan, Wang, Chang, Zhao, Zongya, Liu, Yan, Zhao, Junqiang, Yu, Yi, Yang, Min |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
The Royal Society of Chemistry
2020
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9049714/ https://www.ncbi.nlm.nih.gov/pubmed/35493862 http://dx.doi.org/10.1039/c9ra10085g |
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