Analyzing the Mechanism of Houttuyniae Herba-Leonuri Herba in Treating Systemic Lupus Erythematosus Based on Network Pharmacology and Molecular Docking Technology
10.13359/j.cnki.gzxbtcm.2024.12.030
- VernacularTitle:基于网络药理学与分子对接技术分析鱼腥草-益母草治疗系统性红斑狼疮的机制
- Author:
Cheng-Zhi SHI
1
;
Kai-Jie WANG
;
Yi-Jiao YAN
;
Wen-Hui DENG
;
Bao-Yuan LU
;
Shuang XIE
;
Dao-Shun SUI
Author Information
1. 广州中医药大学,广东广州 510405
- Keywords:
Houttuyniae Herba;
Leonuri Herba;
systemic lupus erythematosus;
network pharmacology;
molecular docking
- From:
Journal of Guangzhou University of Traditional Chinese Medicine
2024;41(12):3293-3300
- CountryChina
- Language:Chinese
-
Abstract:
Objective To analyze the active components and mechanism of action of Houttuyniae Herba-Leonuri Herba in treating systemic lupus erythematosus(SLE).Methods The main chemical components of Houttuyniae Herba-Leonuri Herba and their targets through Traditional Chinese Medicine Systems Pharmacology Database and Analysis Platform(TCMSP)were obtained,and the active components of the Chinese medicine according to ADME were screened;the potential therapeutic targets of SLE through Genecards database were obtained.The protein-protein interactions(PPI)network was constructed by using the STRING 12.0 database,and the potential protein functional modules in the network was mined.The molecular docking technique was used to further validate the action mechanism of components and targets which played a therapeutic role.Results A total of 198 Houttuyniae Herba-Leonuri Herba-SLE intersection targets were obtained.Core active ingredients such as isothermalone,iso-preleoheterin,kaempferol,and quercetin and core targets such as IL6,AKT1,SRC,STAT3 and EGFR were screened out.A total of 1 001 entries were screened by Gene Ontology(GO)functional enrichment analysis,which were mainly related to the reaction of proteins and their kinases,and inflammation,etc..A total of 166 pathways were enriched in Kyoto Encyclopedia of Genes and Genomes(KEGG),including cancer pathway,PI3K-Akt signaling pathway,neuroactive ligand-receptor pathway,and so on.Molecular docking results showed that the core active components of Houttuyniae Herba-Leonuri Herba had great binding activities with their core targets,which preliminarily verified the above network pharmacology results.Conclusion Houttuyniae Herba-Leonuri Herba may exerts a therapeutic effect on SLE through core ingredients such as isothermalone acting on core targets such as IL6,AKT1,SRC,STAT3 and EGFR,and regulating cancer pathway,PI3K-Akt signaling pathway and neuroactive ligand-receptor interaction.
