[1]王贺松,姜 楠,杨 岚,等.基于网络药理学和分子对接探究夏枯草治疗乳腺增生的作用机制[J].医学信息,2024,37(10):11-16.[doi:10.3969/j.issn.1006-1959.2024.10.003]
　WANG He-song,JIANG Nan,YANG Lan,et al.The Mechanism of Prunella Vulgaris L. in the Treatment of Hyperplasia of Mammary Gland Based on Network Pharmacology and Molecular Docking[J].Journal of Medical Information,2024,37(10):11-16.[doi:10.3969/j.issn.1006-1959.2024.10.003]
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基于网络药理学和分子对接探究夏枯草治疗乳腺增生的作用机制()
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医学信息[ISSN:1006-1959/CN:61-1278/R]

卷:
37卷
期数:
2024年10期
页码:
11-16
栏目:
中医药信息学
出版日期:
2024-05-15

文章信息/Info

Title:
The Mechanism of Prunella Vulgaris L. in the Treatment of Hyperplasia of Mammary Gland Based on Network Pharmacology and Molecular Docking
文章编号:
1006-1959（2024）10-0011-06
作者:
王贺松; 姜 楠; 杨 岚; 等
（皖南医学院药学院，安徽 芜湖 241002）
Author(s):
WANG He-song; JIANG Nan; YANG Lan; et al.
(School of Pharmacy,Wannan Medical College,Wuhu 241002,Anhui,China)
关键词:
夏枯草; 乳腺增生; 网络药理学; 分子对接; 雌激素信号通路
Keywords:
Prunella vulgaris L.; Hyperplasia of mammary gland; Network pharmacology; Molecular docking; Estrogen signaling pathway
分类号:
R285
DOI:
10.3969/j.issn.1006-1959.2024.10.003
文献标志码:
A
摘要:
目的 基于网络药理学和分子对接技术探究夏枯草治疗乳腺增生的作用机制。方法 利用TCMSP数据库和GeneCards数据库获取化合物和疾病相关靶点，利用String数据库和Cytoscape3.8.2软件构建蛋白相互作用网络，应用R软件进行GO功能和KEGG通路富集分析，最后应用AutoDock Vina软件进行分子对接验证。结果 共筛选出13个活性成分和117个潜在靶点，潜在靶点涉及应激反应、信号传导、转录调控和细胞周期调控等生物学过程以及雌激素信号通路等与乳腺增生密切相关的通路。分子对接结果显示雌激素信号通路中AKT、MAPK1、CREB、PGR与对应活性成分均能形成稳定构象。结论 夏枯草通过多成分、多靶点、多途径协同作用，发挥治疗乳腺增生的作用。
Abstract:
bjective To explore the mechanism of Prunella vulgaris L. in the treatment of hyperplasia of mammary gland based on network pharmacology and molecular docking technology.Methods TCMSP database and GeneCards database were used to obtain compounds and disease-related targets. String database and Cytoscape 3.8.2 software were used to construct protein interaction network. R software was used to analyze GO function and KEGG pathway enrichment. Finally, AutoDock Vina software was used for molecular docking verification.Results A total of 13 active ingredients and 117 potential targets were screened out. The potential targets involved biological processes such as stress response, signal transduction, transcriptional regulation and cell cycle regulation, as well as estrogen signaling pathway and other pathways closely related to breast hyperplasia. Molecular docking results showed that AKT, MAPK1, CREB, PGR and corresponding active components in the estrogen signaling pathway could form a stable conformation.Conclusion Prunella vulgaris L. plays a role in the treatment of hyperplasia of mammary gland through multi-component, multi-target and multi-channel synergy.

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更新日期/Last Update: 1900-01-01