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基于网络药理学和分子对接分析的夏枯草治疗糖尿病合并高血压的机制研究。

Study on the Mechanism of Prunella Vulgaris L on Diabetes Mellitus Complicated with Hypertension Based on Network Pharmacology and Molecular Docking Analyses.

机构信息

College of Traditional Chinese Medicine, Shandong University of Traditional Chinese Medicine, Jinan, China.

ChaYeKou Town Health Center of LaiWu District, Jinan, China.

出版信息

J Diabetes Res. 2021 Oct 15;2021:9949302. doi: 10.1155/2021/9949302. eCollection 2021.

DOI:10.1155/2021/9949302
PMID:34692849
原文链接:https://pmc.ncbi.nlm.nih.gov/articles/PMC8536441/
Abstract

The role of traditional Chinese medicine Prunella vulagaris L in the treatment of tumors and inflammation has been widely confirmed. We found that some signaling pathways of Prunella vulgaris L action can also regulate diabetes and hypertension, so we decided to study the active ingredients, potential targets and signaling pathway of Prunrlla vulgaris L, and explore the "multi-target, multi-pathway" molecular mechanism of Prunella vulgaris L on diabetes mellitus complicated with hypertension(DH). . Based on TCMSP(Traditional Chinese Medicine Systems Pharmacology Database and Analysis Platform) and CNKI(China National Knowledge Infrastructure), the components and action targets related to Prunella vulgaris L were screened. The OMIM(Online Mendelian Inheritance in Man) and GeneCards (The human gene database) were used to search for targets related to DH. The "gene - drug - disease" relationship map was drawn by Cytoscape_v3.7.2 plug-in. The target was amplified by the STRING platform, and the "protein - protein" interaction relationship (PPI) network of the interacting target was obtained by the STRING online analysis platform and the Cytoscape_v3.7.2 plug-in. Finally, GO enrichment analysis and KEGG pathway enrichment analysis were conducted on David and Metascape platform to study the co-acting targets. Results. 11 active components, 41 key targets and 16 significant signaling pathways were identified from Prunella vulgaris L. The main active components of Prunella vulgaris L against DH were quercetin and kaumferol, etc, and potential action targets were IL-6 and INS, etc and signaling pathways were AGE-RAGE signaling pathway, TNF signaling pathway, MAPK signaling pathway, PI3K-AKT signaling pathway, etc. It involves in biological processes such as cell proliferation, apoptosis and inflammatory response. . The main molecular mechanism of Prunella vulgaris L against DH is that sterols and flavonoids play an active role by affecting TNF signaling pathway, AGE-RAGE signaling pathway, MAPK pathway, PI3K-Akt pathway related targets such as IL-6 and INS.

摘要

中草药夏枯草在治疗肿瘤和炎症方面的作用已得到广泛证实。我们发现,夏枯草的某些作用信号通路也可以调节糖尿病和高血压,因此我们决定研究夏枯草的活性成分、潜在靶点和信号通路,并探讨夏枯草治疗糖尿病合并高血压(DH)的“多靶点、多通路”分子机制。基于 TCMSP(中药系统药理学数据库和分析平台)和 CNKI(中国知识基础设施),筛选与夏枯草相关的成分和作用靶点。利用 OMIM(在线孟德尔遗传数据库)和 GeneCards(人类基因数据库)搜索与 DH 相关的靶点。通过 Cytoscape_v3.7.2 插件绘制“基因-药物-疾病”关系图。通过 STRING 平台对靶标进行扩增,通过 STRING 在线分析平台和 Cytoscape_v3.7.2 插件获得相互作用靶标的“蛋白质-蛋白质”相互作用网络(PPI)。最后,在 David 和 Metascape 平台上进行 GO 富集分析和 KEGG 通路富集分析,研究共同作用靶标。结果:从夏枯草中鉴定出 11 种活性成分、41 个关键靶标和 16 个显著信号通路。夏枯草治疗 DH 的主要活性成分有槲皮素、山奈酚等,潜在作用靶点有 IL-6、INS 等,信号通路有 AGE-RAGE 信号通路、TNF 信号通路、MAPK 信号通路、PI3K-Akt 信号通路等,涉及细胞增殖、凋亡、炎症反应等生物学过程。夏枯草治疗 DH 的主要分子机制是甾醇和类黄酮通过影响 TNF 信号通路、AGE-RAGE 信号通路、MAPK 通路、PI3K-Akt 通路等相关靶点如 IL-6、INS 发挥作用。

https://cdn.ncbi.nlm.nih.gov/pmc/blobs/dd29/8536441/36f5c316f4c8/JDR2021-9949302.007.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/dd29/8536441/602994daf969/JDR2021-9949302.001.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/dd29/8536441/78559a32190c/JDR2021-9949302.002.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/dd29/8536441/525f5c94f6a6/JDR2021-9949302.003.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/dd29/8536441/d60c114834ce/JDR2021-9949302.004.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/dd29/8536441/af5b8581e6ae/JDR2021-9949302.005.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/dd29/8536441/3e7d84598c6e/JDR2021-9949302.006.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/dd29/8536441/36f5c316f4c8/JDR2021-9949302.007.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/dd29/8536441/602994daf969/JDR2021-9949302.001.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/dd29/8536441/78559a32190c/JDR2021-9949302.002.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/dd29/8536441/525f5c94f6a6/JDR2021-9949302.003.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/dd29/8536441/d60c114834ce/JDR2021-9949302.004.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/dd29/8536441/af5b8581e6ae/JDR2021-9949302.005.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/dd29/8536441/3e7d84598c6e/JDR2021-9949302.006.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/dd29/8536441/36f5c316f4c8/JDR2021-9949302.007.jpg

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