Discovery of novel IRAK-4 inhibitors through multi-level virtual screening pipeline and molecular dynamics simulations

已完结 10 由小小发布于 2025/6/18 12:00:15

DOI:10.1016/j.molstruc.2025.142666
作者：Roufen Chen ,&nbsp;Xinglong Chi ,&nbsp;Xinle Yang ,&nbsp;Xin Zhang ,&nbsp;Runmei Chen ,&nbsp;Zhichao Pan ,&nbsp;Chenpeng Yao ,&nbsp;Wenhai Huang ,&nbsp;Zhilu Chen
文献类型：期刊论文
补充材料：只需要正文

Elsevier

Abstract：In this study, we utilized a multi-level virtual screening pipeline to identify a novel IRAK4 inhibitor, 1038620-68-6, which exhibited potent inhibitory activity with an IC50 value of 14.44

应助信息

求助已完结，文件已删除 如有需求请重新发布求助一键发布

感谢使用Book学术
本站所有文献仅供个人学习和参考，请勿将文件进行传播。共同遵守网站规定和相关知识产权规定。

上一个求助:其它数据库Naturally Fractured Carbonate Reservoir Characterization: A Case Study of a Mature High-Pour Point Oil Field in Hungary 下一个求助:American Chemical Society (ACS)Covalent Organic Framework Membranes: Synthesis Strategies and Separation Applications