癌变·畸变·突变2024,Vol.36Issue(2) :118-123.DOI:10.3969/j.issn.1004-616x.2024.02.006

基于网络药理学探讨葛根治疗肝损伤的作用机制

Network pharmacology-based prediction of Pueraria lobata for treating liver injury

刘师卜 郑济凡 张励 马利波 朵慧 刘梦琪
癌变·畸变·突变2024,Vol.36Issue(2) :118-123.DOI:10.3969/j.issn.1004-616x.2024.02.006

基于网络药理学探讨葛根治疗肝损伤的作用机制

Network pharmacology-based prediction of Pueraria lobata for treating liver injury

刘师卜 1郑济凡 1张励 1马利波 1朵慧 1刘梦琪1
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作者信息

  • 1. 中国食品药品检定研究院,北京 100050
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摘要

目的:探究葛根治疗肝损伤的有效成分、靶标和作用通路,为葛根用于肝损伤的治疗提供理论依据.方法:基于中医药整合药理学网络计算平台(TCMIP)、中药综合资源数据库(TCMID)、中药系统药理数据库和分析平台(TCMSP)、人类基因数据库(GeneCards)等公共数据库和KEGG通路分析等网络药理学基本方法预测葛根治疗肝损伤的作用机制.结果:葛根主要活性成分靶点与肝损伤靶点具有交集,功能分析、富集分析和分子对接发现,刺芒柄花素、β-谷甾醇与雌激素受体1(ESR1),香豆雌酚、3′-甲氧基大豆黄素与PPARG与之间对接具有良好的亲和力,其中刺芒柄花素与ESR1之间作用力最强(-8.04 kcal/mol).推断葛根治疗肝损伤的机制与ESR1和PPARG介导的路径相关.结论:葛根治疗肝损伤可能通过ESR信号通路、PPAR-γ激活和调节靶基因转录等发挥调节肝细胞的生长、分化和生理功能,减轻氧化应激性肝损伤和肝细胞凋亡的作用.

Abstract

OBJECTIVE:To investigate the active ingredients,targets, action pathways and mechanisms of actions of Pueraria lobata for treating liver injury. METHODS:According to the public databases such as TCMID, TCMIP, TCMSP, GeneCards, and basic network pharmacological methods such as KEGG pathway analysis, potential pathways of pueraria for treating liver injury were predicted. RESULTS:The main active components of puerariae showed intersection with liver injury. Functional analysis , enrichment analysis and molecular docking showed that formononetin,β-sitosterol and ESR1, coumestrol, 3′-methoxydaidzein and PPARG have good affinity for docking. The interaction between formononetin and ESR1 was the strongest (-8.04 kcal/mol). It was concluded that the mechanism of Pueraria lobata treating liver injury was related to ESR1 and PPARg-mediated pathway. CONCLUSION:The use of Pueraria lobata for treatment of liver injury may be mainly due to regulating the growth, differentiation and physiological functions of hepatocytes through estrogen receptor signaling pathway and PPAR-γ activation and regulation of target gene transcription expression pathway,and alleviating the mechanism of oxidative stress induced liver injury and hepatocyte apoptosis.

关键词

网络药理学/葛根/肝损伤/活性成分/作用机制

Key words

network pharmacology/Pueraria lobata/liver injury/active ingredient/mechanism

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基金项目

保健食品功能目录专项(1010040404404)

出版年

2024
癌变·畸变·突变
中国环境诱变剂学会

癌变·畸变·突变

CSTPCD
影响因子:0.35
ISSN:1004-616X
参考文献量30
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