1. 基于网络药理学和分子对接技术的含笑内醋缓解 痛风性关节炎作用机制研究 .
- Author
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王冰, 王兰, and 秦向阳
- Abstract
To investigate the potential targets and related mechanisms of micheliolide (MCL) in alleviating gouty arthritis (GA). The network pharmacology technology was used to retrieve MCL and GA related targets, screen their intersection targets, construct protein interaction maps and screen core targets. Enrichment analysis of Gene Ontology (GO) and Kyoto Encyclopedia of Genes and Genomes (KEGG) was conducted, the ″MCL-target-pathway-GA″ network diagram was drawn, and molecular docking verification of MCL and core target was conducted. Results A total of 778 MCL related targets, 351 GA related targets and 58 intersection targets were screened out. Twenty-four targets were predicted to be the core targets of MCL inalleviating GA, such as TNF, IL-1B (IL-1β) and so on. GO analysis confirmed 294 items related to biological process (BP), 38 items related to cellular components (CC) and 57 items related to molecular function (MF). KEGG analysis revealed 105 signaling pathways, including inflammation, metabolism, infection and tumor. The molecular docking results showed that MCL binds tightly to the core target of TNF and IL-1B (IL-1β) by hydrogen bonding, and the MCL binds most tightly to the core target of IL-1B (IL-1β). The core targets and related biological processes and signaling pathways of MCL alleviating GA were preliminarily predicted, and molecular docking verification was carried out, providing ideas for further in vivo and in vitro experiments. [ABSTRACT FROM AUTHOR]
- Published
- 2023