中国中医药图书情报杂志2026，Vol.50Issue(1)：30-35,6.DOI:10.3969/j.issn.2095-5707.202505029
基于网络药理学与分子对接探究天葵子与预知子抗肝癌作用机制
Exploration on the Mechanism of Semiaquilegiae Radix and Akebiae Frucyus against Liver Cancer Based on Network Pharmacology and Molecular Docking
摘要
Abstract
Objective To investigate the targets and potential molecular mechanisms of the combination therapy of Semiaquilegiae Radix and Akebiae Frucyus in the treatment of liver cancer.Methods The active components and the targets of Semiaquilegiae Radix and Akebiae Frucyus were obtained from the TCMSP and SwissTargetPrediction databases.Liver cancer targets were collected through GeneCards and OMIM databases.The drug-component-target-disease network was constructed by Cytoscape 3.10.2.Based on the STRING database,the protein interaction(PPI)network of the co-targets of drugs and liver cancer was established,and the core genes were screened.Target gene enrichment analysis was further performed,and the binding ability of core genes and active components was tested by molecular docking technology.Results After screening,7 and 6 active components contained in Semiaquilegiae Radix and Akebiae Frucyus were obtained,corresponding to 402 and 306 potential targets,respectively.6 838 targets related to liver cancer were obtained,and the core targets included HIF1A,CCND1,ESR1,CASP3 and HSP90AA1.Enrichment analysis showed that the signaling pathways involved in Semiaquilegiae Radix and Akebiae Frucyus in the treatment of liver cancer were mainly cancer-related pathway,apoptosis pathway,tumor proteoglycan metabolism pathway,Rap1 signaling pathway and Ras signaling pathway.Molecular docking analysis showed that the main active components of Semiaquilegiae Radix and Akebiae Frucyus showed strong binding activity with key target proteins of liver cancer.Conclusion Semiaquilegiae Radix-Akebiae Frucyus exerts a synergistic anti-liver cancer effect by regulating the key targets HIF1A,CCND1 and HSP90AA1 through various active components,including berberrubine,β-sitosterol and sitosterol.关键词
天葵子/预知子/肝癌/网络药理学/分子对接Key words
Semiaquilegiae Radix/Akebiae Frucyus/liver cancer/network pharmacology/molecular docking分类
医药卫生引用本文复制引用
苏倩,段航喆,王维逸,李沐儒,刘思晨,王栋洋..基于网络药理学与分子对接探究天葵子与预知子抗肝癌作用机制[J].中国中医药图书情报杂志,2026,50(1):30-35,6.基金项目
国家级大学生创新创业训练计划(S202410545015) （S202410545015）
湖南省卫生健康委科研计划(B202304088570) （B202304088570）
湘南学院大学生创新创业训练计划(X2023067) （X2023067）
