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基于网络药理学的宣肺败毒汤治疗新型冠状病毒肺炎的作用机制

[Mechanism of Xuanfei Baidu Tang in treatment of COVID-19 based on network pharmacology].

作者信息

Wang Yi, Li Xiang, Zhang Jun-Hua, Xue Rui, Qian Jing-Yang, Zhang Xiao-Hui, Zhang Han, Liu Qing-Quan, Fan Xiao-Hui, Cheng Yi-Yu, Zhang Bo-Li

机构信息

Department of Chinese Medicine Science & Engineering, Zhejiang University Hangzhou 310058, China.

School of Basic Medical Sciences & Forensic Medicine, Hangzhou Medical College Hangzhou 310053, China.

出版信息

Zhongguo Zhong Yao Za Zhi. 2020 May;45(10):2249-2256. doi: 10.19540/j.cnki.cjcmm.20200325.401.

Abstract

The study aimed to investigate the multi-constituent, multi-target mechanism of Xuanfei Baidu Tang(XFBD) in the treatment of coronavirus disease 2019(COVID-19), through exploring the main ingredients and effective targets of XFBD, as well as analyzing the correlation between XFBD targets and COVID-19. The compounds of each herb in XFBD were collected from TCM-PTD, ETCM, TCMSP and SymMap database. Next, the information of meridian tropisms was collected from Chinese Pharmacopoeia(2015 edition), and the target information of the major constituents of XFBD were obtained from TCM-PTD, ETCM, TCMSP and TargetNet database. Subsequently, the target network model and the major modules were generated by Cytoscape, and the functional enrichment analysis of XFBD targets were completed by DAVID and STRING. As a result, ten of the 13 herbs in XFBD belonged to the lung meridian, and 326 of the 1 224 putative XFBD targets were associated with the disease target of COVID-19, among which 109 targets were enriched in the disease pathways of viral infection and lung injury. The main biological pathways regulated by the key XFBD targets included viral infection, energy metabolism, immunity and inflammation, parasites and bacterial infections. In conclusion, the therapeutic mechanism of XFBD in COVID-19 showed a multi-herb, multi-constituent, multi-target pattern, with lung as the chief targeted organ. By regulating a series of biological pathways closely related to the occurrence and development of diseases, XFBD plays a role in balancing immunity, eliminating inflammation, regulating hepatic and biliary metabolism and recovering energy metabolism balance.

摘要

本研究旨在通过探索宣肺败毒汤(XFBD)的主要成分和有效靶点,并分析XFBD靶点与2019冠状病毒病(COVID-19)之间的相关性,来研究宣肺败毒汤治疗COVID-19的多成分、多靶点机制。XFBD中各味药材的化合物信息从中药方剂数据库(TCM-PTD)、中药综合数据库(ETCM)、中药系统药理学数据库(TCMSP)和中药分子机制生物信息数据库(SymMap)中收集。接下来,从《中国药典》(2015年版)中收集归经信息,并从TCM-PTD、ETCM、TCMSP和靶点网络数据库(TargetNet)中获取XFBD主要成分的靶点信息。随后,通过Cytoscape生成靶点网络模型和主要模块,并通过DAVID和STRING完成XFBD靶点的功能富集分析。结果显示,XFBD的13味药材中有10味归肺经,1224个推测的XFBD靶点中有326个与COVID-19的疾病靶点相关,其中109个靶点在病毒感染和肺损伤的疾病通路中富集。XFBD关键靶点调控的主要生物学通路包括病毒感染、能量代谢、免疫和炎症、寄生虫和细菌感染。综上所述,XFBD治疗COVID-19的作用机制呈现多药味、多成分、多靶点的模式,以肺为主要靶器官。通过调节一系列与疾病发生发展密切相关的生物学通路,XFBD在平衡免疫、消除炎症、调节肝胆代谢和恢复能量代谢平衡方面发挥作用。

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