Molecular mec hanism of Qibai ointment in the treatment of aestates using pharmacology network and molecular docking
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Molecular mec hanism of Qibai ointment in the treatment of aestates using pharmacology network and molecular docking
Health Medicine Research and PracticeVol. 18, Issue 5, Pages: 56-62(2021)
作者机构:
沈阳医学院药学院
作者简介:
基金信息:
DOI:
CLC:R285
Published:2021,
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Liang Tianye, Shang Lei, Zhang Dajun, et al. Molecular mec hanism of Qibai ointment in the treatment of aestates using pharmacology network and molecular docking. [J]. Health Medicine Research and Practice 18(5):56-62(2021)
DOI:
Liang Tianye, Shang Lei, Zhang Dajun, et al. Molecular mec hanism of Qibai ointment in the treatment of aestates using pharmacology network and molecular docking. [J]. Health Medicine Research and Practice 18(5):56-62(2021)DOI:
Molecular mec hanism of Qibai ointment in the treatment of aestates using pharmacology network and molecular docking
Objective To explore the active molecules in Qibai ointment and their mechanism in the treatment of aestates. Methods Potential active molecules was screened out using Traditional Chinese Medicine Systems Pharmacology Database and Analysis Platform. The targets related to aestates was explored in Genecards database. Then
the network of active molecules and targets of aestates was pictured. String database platform was used to calculate PPI core genes. Finally
Metascape database was using to perform GO enrichment analysis and KEGG enrichment analysis. Results There were 12 potential active molecules in Qibai ointment and 45 genes related to aestates
including IL6
PTGS2
TNF
AKT1
JUN and so on.quercetin
kaempferol
(+)-catechin were key active substances.The results of enrichment analysis showed that IL-17 signaling pathway was the possible key pathway of Qibai ointment in the treating aestates.The results of molecular docking indicated that the molecular interaction between key active substances and targets was strong.Conclusion Quercetin
kaempferol
(+)-catechin in Qibai ointment can treat aestates through IL-17 signaling pathway via many biological processes.