Mechanism of Zhishi Xiebai Guizhi Decoction in the Treatment of Pulmonary Embolism Based on Internet Pharmacology

WANG Wei; GUO Yuanyuan; LIAN Yajun; GE Feilin; LI Jiayi; WANG Tianquan; CAO Junling

doi:10.14009/j.issn.1672-2124.2021.03.002

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Mechanism of Zhishi Xiebai Guizhi Decoction in the Treatment of Pulmonary Embolism Based on Internet Pharmacology

更新时间：2022-10-08

- Mechanism of Zhishi Xiebai Guizhi Decoction in the Treatment of Pulmonary Embolism Based on Internet Pharmacology
- Vol. 21, Issue 3, Pages: 262-268(2021)
- 作者机构：
  
  1. 北京中医药大学中药学院
  2. 北京中医药大学中医学院
  3. 北京中医药大学东方医院药学部
- 作者简介：
- 基金信息：
- DOI：10.14009/j.issn.1672-2124.2021.03.002
  CLC： R285
- Published：2021，
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[1]王苇,郭媛媛,连雅君,葛斐林,李佳怡,王添全,曹俊岭.基于网络药理学探讨枳实薤白桂枝汤治疗肺栓塞的作用机制[J].中国医院用药评价与分析,2021,21(03):262-268.

WANG Wei, GUO Yuanyuan, LIAN Yajun, et al. Mechanism of Zhishi Xiebai Guizhi Decoction in the Treatment of Pulmonary Embolism Based on Internet Pharmacology. [J]. 21(3):262-268(2021)
[1]王苇,郭媛媛,连雅君,葛斐林,李佳怡,王添全,曹俊岭.基于网络药理学探讨枳实薤白桂枝汤治疗肺栓塞的作用机制[J].中国医院用药评价与分析,2021,21(03):262-268. DOI： 10.14009/j.issn.1672-2124.2021.03.002.

WANG Wei, GUO Yuanyuan, LIAN Yajun, et al. Mechanism of Zhishi Xiebai Guizhi Decoction in the Treatment of Pulmonary Embolism Based on Internet Pharmacology. [J]. 21(3):262-268(2021) DOI： 10.14009/j.issn.1672-2124.2021.03.002.

摘要

目的:基于网络药理学方法对枳实薤白桂枝汤进行研究

探讨其治疗肺栓塞的作用机制。方法:根据药物成分的体内过程[吸收（absorption）、分布（distribution）、代谢（metabolism）及排泄（excretion）

ADME]属性

通过中药系统药理学数据库和分析平台（traditional Chinese medicine systems pharmacology database and analysis platform

TCMSP）获取瓜蒌、薤白、枳实、桂枝及厚朴的主要化学成分

并借助中医百科全书（the encyclopedia of traditional Chinese medicine

ETCM）和中医药综合数据库（traditional Chinese medicine integrated database

TCMID）进行补充

筛选中药活性组分

利用Swiss Target Prediction获取活性成分作用靶点;通过Genecards、人类孟德尔遗传综合数据库（online mendelian inheritance in man

OMIM）及DRUGBANK数据库获取肺栓塞主要靶点

利用String平台进行蛋白质-蛋白质相互作用（protein-protein interaction

PPI）分析

构建PPI网络。采用Metascape平台分析"药物-成分-靶点"及其参与的生物过程及通路

运用Cytoscape 3.8.0软件构建"枳实薤白桂枝汤-肺栓塞-通路"网络。结果:枳实薤白桂枝汤治疗肺栓塞的核心活性成分为槲皮素、木犀草素、柚皮素及咖啡酸等

核心靶点为CYP1B1和DRD2等。枳实薤白桂枝汤治疗肺栓塞的生物学通路主要作用于血小板活化通路、神经活性配体-受体相互作用通路等

其功能主要为调节血红素结合、蛋白激酶活性等。结论:本研究初步揭示了枳实薤白桂枝汤治疗肺栓塞的可能的活性成分作用机制

可为后续的基础研究及临床研究提供线索及依据。

Abstract

OBJECTIVE: To probe into the mechanism of Zhishi Xiebai Guizhi decoction in the treatment of pulmonary embolism based on internet pharmacology.METHODS: According to in vivo processes（ absorption

distribution

metabolism and excretion

ADME） properties of the drug components

the main chemical components of trichosanthes

citrus aurantium

guizhi and magnolia officinalis were obtained through traditional Chinese medicine systems pharmacology database and analysis platform（ TCMSP）.And the encyclopedia of traditional Chinese medicine（ ETCM） and traditional Chinese medicines integrated database（ TCMID） were used to supply and screen the active components of traditional Chinese medicine.Swiss Target Prediction was adopted to obtain the active ingredient targets.The major targets of pulmonary embolism were obtained from Genecards

online mendelian inheritance in man（ OMIM） and DRUGBANK databases.Protein-protein interaction（ PPI） was analyzed by using String platform

and PPI network was constructed.Metascape platform was used to analyze"drugs-components-targets"and its involved biological processes and pathways.Cytoscape 3.8.0 software was used to construct the network of"Zhishi Xiebai Guizhi decoction-pulmonary embolism-pathway".RESULTS: The core active ingredients of Zhishi Xiebai Guizhi decoction in the treatment of pulmonary embolism were quercetin

luteolin

naringenin and caffeic acid

and the core targets were CYP1 B1 and DRD2.The biological pathways of Zhishi Xiebai Guizhi decoction in the treatment of pulmonary embolism mainly acted on the platelet activation pathway and the Neuroactive ligand-receptor interaction pathway

the main functions were regulating heme binding and protein kinase activity.CONCLUSIONS:This study initially reveals the possible mechanism of active ingredients of Zhishi Xiebai Guizhi decoction in the treatment of pulmonary embolism

and provides clues and evidence for follow-up basic and clinical research.

关键词

枳实薤白桂枝汤肺栓塞网络药理学作用机制

Keywords

Zhishi Xiebai Guizhi decoctionPulmonary embolismNetwork pharmacologyMechanism of action

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