中国中医药图书情报杂志2025，Vol.49Issue(2)：64-71,8.DOI:10.3969/j.issn.2095-5707.202406118
基于网络药理学和分子对接探讨黄芪-山药、葛根-丹参治疗2型糖尿病合并冠心病作用机制
摘要
Abstract
Objective To explore the mechanism of Astragali Radix-Dioscoreae Rhizoma and Puerariae Lobatue Radix-Salviea Miltiorrhizae Radix et Rhizoma in the treatment of type 2 diabetes mellitus(T2DM)complicated with coronary artery disease(CAD)based on network pharmacology and molecular docking.Methods By using TCMSP,UniProt and integrating literature reports,the chemical components and corresponding targets of Astragali Radix-Dioscoreae Rhizoma and Puerariae Lobatue Radix-Salviea Miltiorrhizae Radix et Rhizoma were retrieved.A Chinese materia medica-active components-target network was constructed using Cytoscape 3.9.1 software.Disease targets were screened through GeneCards,DurgBank,DisGeNET,OMIM and TTD databases.Venny 2.1.0 online platform was used to obtain the intersection targets between active components and diseases.STRING database was utilized to construct a protein-protein interaction network for the intersecting targets and identify core targets.By using Metascape database,GO function and KEGG pathway enrichment analysis were performed on intersection targets,and a Chinese materia medica-disease-active components-target-pathway network was constructed,and core active components were screened.PubChem database,PDB database,PyMOL 2.6.0 and AutoDockTools 1.5.6 software were used for molecular docking verification.Results A total of 93 active components were obtained,the core active components included quercetin,luteolin and puerarin.The PPI network showed that IL6,AKT1 and IL1Bwere the core targets.The results of molecular docking showed that the core components had good binding activity to the core target.Conclusion Astragali Radix-Dioscoreae Rhizoma and Puerariae Lobatue Radix-Salviea Miltiorrhizae Radix et Rhizoma can treat T2DM with CAD through AGE-RAGE,lipid and atherosclerosis,NF-κB signaling pathways,which may be related to inhibiting the secretion of inflammatory factors and regulating the metabolism of glucose and lipid.关键词
黄芪-山药/葛根-丹参/2型糖尿病/冠心病/网络药理学/分子对接Key words
Astragali Radix-Dioscoreae Rhizoma/Puerariae Lobatue Radix-Salviea Miltiorrhizae Radix et Rhizoma/T2DM/CAD/network pharmacology/molecular docking分类
医药卫生引用本文复制引用
王铎,王围,吕树泉,张忠勇..基于网络药理学和分子对接探讨黄芪-山药、葛根-丹参治疗2型糖尿病合并冠心病作用机制[J].中国中医药图书情报杂志,2025,49(2):64-71,8.基金项目
王元松全国名老中医药专家传承工作室建设项目(2022年) （2022年）
