首页|基于网络药理学和分子对接探讨黄芪-川芎配伍治疗瘢痕的作用机制

基于网络药理学和分子对接探讨黄芪-川芎配伍治疗瘢痕的作用机制

扫码查看
基于网络药理学探讨黄芪-川芎配伍治疗瘢痕的作用机制.通过TCMSP数据库筛选出黄芪和川芎的有效成分及其靶点,同时使用OMIM、GeneCards和DrugBank数据库获取得到黄芪-川芎配伍治疗瘢痕的潜在交集靶点.采用Cytoscape3.7.0软件构建中药-有效成分-靶点-疾病网络,并通过STRING数据库构建PPI网络,利用微生信网站进行KEGG富集分析及GO功能分析可视化,再佐以分子对接验证.结果显示,共筛选得到川芎有效成分7个,对应靶点42个;黄芪有效成分20个,对应靶点462个;瘢痕靶点2216个.黄芪-川芎配伍治疗瘢痕的关键成分有槲皮素和山柰酚等;治疗瘢痕的关键靶点是TP53和白细胞介素6等.KEGG富集分析结果表明,黄芪-川芎主要与IL-17信号通路和TNF信号通路有关.分子对接表明,黄芪-川芎主要活性成分槲皮素、山柰酚和杨梅酮与关键靶点AKT1、IL6和TNF具有良好的稳定性.本文基于网络药理学和分子对接验证研究表明,黄芪和川芎可能通过多成分、多靶点和多通路来治疗瘢痕.
Based on Network Pharmacology and Molecular Docking to Explore the Mechanism of Astragalus Membranaceus-Ligusticum sinense Combination in Treating Scar
To explore the mechanism of the combination of Astragalus membranaceus-Ligusticum sinense in the treatment of scar through network pharmacology.The effective components and their targets of A.membranaceus and L.sinense were screened by TCMSP database.Scar targets were obtained using OMIM,GeneCards and DrugBank databases.The intersection target of A.membranaceus and L.sinense in the treatment of scar was obtained.Cytoscape 3.7.0 software was used to construct TCM-active ingredient-target-disease network.Construct PPI network through STRING database.KEGG enrichment and GO fuction analysis were visualized using Weisheng website.It is verified by molecular docking.A total of 7 active ingredients of L.sinense were screened,which corresponded to 42 targets.There were 20 active ingredients of A.membranaceus,corresponding to 462 targets.There were 2 216 scar targets.The key ingredients of A.membranaceus-L.sinense combination in treating scar include quercetin and kaempferol.The key targets of scar treatment are TP53 and interleukin 6.KEGG enrichment analysis showed that it was mainly related to IL-17 signaling pathway and TNF signaling pathway.Molecular docking showed that the main active components had good stability with the key targets.Based on the analysis of network pharmacology and molecular doc-king verification,this paper shows that A.membranaceus and L.sinense may treat scar through multi-component,multi-target and multi-pathway.

Astragalus membranaceusLigusticum sinensescarnetwork pharmacology

洪玉书、宋张婕、张佳欢、刘婧、李玉梅

展开 >

长春中医药大学药学院,吉林 长春 130117

黄芪 川芎 瘢痕 网络药理学

省级大学生创新创业训练计划长春中医药大学"杏林学者工程"青年科学家计划

S202110199056

2024

特产研究
中国农业科学院特产研究所,中国农学会特产学会

特产研究

CSTPCD
影响因子:0.331
ISSN:1001-4721
年,卷(期):2024.46(3)
  • 31