Suppr超能文献

基于网络药理学和分子对接技术的头花蓼干预肺纤维化机制的研究进展。

Mechanism of Polygonum capitatum intervention in pulmonary fibrosis based on network pharmacology and molecular docking technology: A review.

机构信息

School of Pharmacy, Guizhou University of Traditional Chinese Medicine, Guiyang, China.

School of Preclinical Medicine, Guizhou University of Traditional Chinese Medicine, Guiyang, China.

出版信息

Medicine (Baltimore). 2023 Sep 15;102(37):e34912. doi: 10.1097/MD.0000000000034912.

Abstract

Pulmonary fibrosis (PF) is a serious interstitial disease that includes diffuse collagen deposition of lung tissue. Polygonum capitatum Buch.-Ham. ex D. Don (THL) is a traditional vaccine that has antibacterial and anti-inflammatory effects. In this research, to investigate the mechanism of action of THL in the intervention of pulmonary fibrosis by network pharmacology and molecular docking related research methods, in order to provide a theoretical basis for expanding the scope of THL medication. A total of 49 active ingredients were analyzed and screened in Cephalus cephalusis, including 35 pulmonary fibrosis targets, and 10 key targets such as ALB, EGFR were screened after software analysis. The molecular docking results showed that there were 44 binding energies less than -3 kcal·mol-1 in the 60 docking results, indicating that most proteins had strong binding energies with compounds. The key targets of KEGG enrichment analysis were mainly enriched in 20 core action pathways, such as hemostasis-related pathway, regulation of kinase activity. This study shows that based on network pharmacology, the multicomponent-multitarget-multipathway effect of THL intervention in pulmonary fibrosis is discussed.

摘要

肺纤维化(PF)是一种严重的间质性疾病,包括肺部组织的弥漫性胶原沉积。虎杖(Polygonum capitatum Buch.-Ham. ex D. Don)是一种传统的疫苗,具有抗菌和抗炎作用。在这项研究中,我们采用网络药理学和分子对接相关研究方法,探讨虎杖干预肺纤维化的作用机制,以期为扩大虎杖用药范围提供理论依据。通过软件分析,从虎杖中分析和筛选出 49 种活性成分,包括 35 个肺纤维化靶点,筛选出 ALB、EGFR 等 10 个关键靶点。分子对接结果表明,在 60 个对接结果中,有 44 个结合能小于-3 kcal·mol-1,表明大多数蛋白质与化合物具有很强的结合能。KEGG 富集分析的关键靶点主要富集在 20 个核心作用途径中,如止血相关途径、激酶活性调节。本研究表明,基于网络药理学,探讨了虎杖干预肺纤维化的多成分-多靶点-多途径作用。

https://cdn.ncbi.nlm.nih.gov/pmc/blobs/5fe5/10508485/b8e1533ec84b/medi-102-e34912-g001.jpg

文献AI研究员

20分钟写一篇综述,助力文献阅读效率提升50倍。

立即体验

用中文搜PubMed

大模型驱动的PubMed中文搜索引擎

马上搜索

文档翻译

学术文献翻译模型,支持多种主流文档格式。

立即体验