中医临床研究2025，Vol.17Issue(12)：41-48,8.DOI:10.3969/j.issn.1674-7860.2025.12.008
基于网络药理学和分子对接技术探讨石菖蒲治疗宫颈炎的作用机制
A study on the mechanism of Shichangpu in the treatment of cervicitis based on network pharmacology and molecular docking technology
摘要
Abstract
Objective:To explore the possible mechanism of Shichangpu(Acori Tatarinowii Rhizoma)in the treatment of cervicitis based on network pharmacology and molecular docking technology.Methods:The compounds of Shichangpu were collected in the TCMSP and TCM databases,the active compounds were screened through the PubChem database,and the potential targets of the active compounds were predicted using the SwissTargetPrediction and PharmMapper databases.The main targets of cervicitis were obtained from GeneCards,OMIM,TTD,and DRUGBANK databases.Venn diagram of common drug targets of Shichangpu for cervicitis was constructed to analyze the protein-protein interaction network of common targets,so as to screen the key targets.GO and KEGG pathway enrichment analyses for active compound targets were performed through Metascape online website.The"Shichangpu-cervicitis-target-signaling pathway"network was established.Molecular docking technology was used to verify the molecular docking of the active components of Shichangpu and targets.Results:There were 9 ingredients,207 common targets,and 73 key targets of Shichangpu.The main action pathways included cancer pathway,Wnt signaling pathway,NF-κB signaling pathway and so on.The results of molecular docking showed that α-asaryl ether,β-asaryl ether,eucalyptus,eugenol,kaempferol and other active ingredients of Shichangpu had good docking activity with CASP3,SRC,VEGFA and other proteins.Conclusion:Shichangpu may play a role in the treatment of cervicitis by acting on targets such as AKT1,ALB,VEGFA,EGFR,and CASP3 through signaling pathways such as cancer pathway,nitrogen metabolism,cervical adhesions,Wnt signaling pathway,and NF-κB signaling pathway.关键词
石菖蒲/宫颈炎/网络药理学/分子对接/作用机制Key words
Shichangpu/Cervicitis/Network pharmacology/Molecular docking/Mechanism分类
医药卫生引用本文复制引用
薛中峰,殷敬凡,郭亚蕾,方家..基于网络药理学和分子对接技术探讨石菖蒲治疗宫颈炎的作用机制[J].中医临床研究,2025,17(12):41-48,8.基金项目
广西自然科学基金项目(2020GXNSFBA238008) （2020GXNSFBA238008）
海南热带海洋学院人才科研启动项目(RHDRC202303,RHDRC202304) （RHDRC202303,RHDRC202304）
广西中医药大学校级课题(2017MS024) （2017MS024）
江西省卫生健康委科技计划项目(SKJP2202226962) （SKJP2202226962）
江西省中医药管理局科技计划课题(SZYYB20205439). （SZYYB20205439）
