首页|基于数据挖掘和网络药理学围绝经期血管舒缩症状的用药规律及机制研究

基于数据挖掘和网络药理学围绝经期血管舒缩症状的用药规律及机制研究

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目的:基于文献挖掘中医药治疗围绝经期血管舒缩症状的用药规律,研究分析核心组分的机制.方法:收集中国知网、维普中文期刊服务平台、中国生物医学文献服务系统自建库至2023年12月的相关文献,利用Microsoft Excel 2016、SPSS Statistics 22.0、Cytoscape等软件分析文献里中药复方的用药规律,通过TCMSP、GeneCards、DisGeNET和TTD数据库获得中药和疾病的交集靶点,进行蛋白质-蛋白质相互作用网络构建、基因本体论(GO)和京都基因与基因组百科全书(KEGG)富集分析,采用Autodock进行分子对接验证.结果:共筛选出文献26篇,涉及中药处方42首、中药79味,分析得到核心组分4个.分析核心组分"黄连、黄芩、熟地黄、当归、黄柏、地黄和黄芪"(即当归六黄汤),得到73个活性成分、238个有效靶点、512个疾病靶点和69个交集靶点,活性成分主要为槲皮素、β-谷甾醇、豆甾醇等.核心靶点为白细胞介素-6(Interleukin-6,IL-6)、肿瘤坏死因子(Tumor Necrosis Factor,TNF)和IL-1β等,涉及20个生物过程条目、14个细胞成分条目、18个分子功能条目及20条KEGG信号通路.分子对接结果验证了活性成分和核心靶点之间能自发结合,且相互作用较强.结论:通过数据挖掘和网络药理学分析可知,治疗围绝经期血管舒缩症状应以补虚滋肾、清热降火为主,核心组方当归六黄汤能通过多成分、多靶点和多通路发挥作用.
A study on medication rule and mechanism of TCM in the treatment of perimenopausal vasomotor symptoms based on data mining and network pharmacology
Objective:To explore the medication rules of traditional Chinese medicine(TCM)in the treatment of vasomotor symptoms in perimenopausal period based on data mining and network pharmacology,and study the mechanism of core component.Method:The literature related to disease was collected from CNKI,VIP,and SinoMed since the establishment of the database.Microsoft Excel 2016,SPSS Statistics 22.0,Cytoscape software were used to analyze the medication rules of TCM compounds in the included literature.The intersection targets of TCM and diseases were obtained by TCMSP,GeneCards,DisGeNET and TTD databases.PPI network was constructed,GO and KEGG enrichment analyses were performed,and molecular docking was verified by Autodock.Results:A total of 26 literatures,42 TCM prescriptions and 79 TCM flavors were selected,and 4 core components were obtained.After analyzing the core components of"Coptidis rhizoma,Scutellariae radix,Radix Rehmanniae Praeparata,Angelica sinensis,Phellodendri chinensis cortex,Rehmanniae radix and Astragali radix",namely Danggui Liuhuang decoction(当归六黄汤),a total of 73 active ingredients,238 effective targets,512 disease targets,and 69 intersecting targets were obtained.The main active ingredients were quercetin,β-sitosterol,stigmasterol,etc..The core targets were IL-6,TNF,IL-1β,etc..It involved 20 BP items,14 CC items,18 MF items,and 20 KEGG biological pathway items.Molecular docking results verified the spontaneous binding and strong interaction between active components and core targets.Conclusion:Through data mining and network pharmacology,it is known that the treatment of Perimeno pausal vasomotor symptoms should mainly focus on tonifying and nourishing the kidneys,and clearing heat and reducing fire.The core component of Danggui Liuhuang decoction can play its role through multiple components,multiple targets and multiple pathways.

Perimenopausal periodVasomotor symptomData miningNetwork pharmacologyMedication rule

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广东医科大学科研平台管理服务中心,广东 东莞,523000

围绝经期 血管舒缩症状 数据挖掘 网络药理学 用药规律

2024

中医临床研究
中华中医药学会

中医临床研究

影响因子:0.839
ISSN:1674-7860
年,卷(期):2024.16(29)