Prediction of the"Efficacy Component Group"for Alcohol Detoxification and Liver Protection in Puerariae Lobatue Radix Based on UPLC Fingerprint and Network Pharmacology
10.19879/j.cnki.1005-5304.202505605
- VernacularTitle:基于UPLC指纹图谱和网络药理学预测葛根解酒护肝的"功效成分族"
- Author:
Lei SHEN
1
;
Xingming JIANG
;
Si HONG
;
Dingming LIU
;
Yumeng KONG
;
Siqi HUANG
;
Xiaoxuan LIU
;
Xinlin ZHONG
;
Wenlong LIU
;
Xili ZHANG
Author Information
1. 湖南中医药大学药学院,湖南 长沙 410208;中药成药性与制剂制备湖南省重点实验室,湖南 长沙 410208
- Publication Type:Journal Article
- Keywords:
Puerariae Lobatue Radix;
fingerprint;
chemical pattern recognition;
quality markers;
alcohol-associated liver disease;
efficacy component group;
network pharmacology;
molecular docking
- From:
Chinese Journal of Information on Traditional Chinese Medicine
2025;32(11):133-141
- CountryChina
- Language:Chinese
-
Abstract:
Objective To explore the quality markers of Puerariae Lobatue Radix;To predict its"efficacy component group"with alcohol detoxification and liver protection effects.Methods Fingerprints of 26 batches of Puerariae Lobatue Radix samples from different origins in China was established.Multivariate statistical analysis was employed to identify quality markers,while network pharmacology and molecular docking were used to predict the potential"efficacy component group".Results UPLC fingerprint analysis calibrated 11 common peaks.Clustering analysis classified 26 batches of samples into 3 categories,and 7 quality markers were ultimately screened through multivariate statistical analysis,including mirificin,puerarin,puerarin-6''-O-xyloside,3'-methoxypuerarin,ononin,genistin and daidzin.Network pharmacology revealed that all 7 markers interacted with targets related to alcohol-associated liver disease,identifying 19 core targets such as TNF,CASP3,BCL2,MMP9,IL2,and 93 signaling pathways involving IL-17 and PI3K-Akt signaling pathways.Molecular docking demonstrated strong binding affinity between the 7 markers and target proteins,with binding energies<-5 kcal/mol.Conclusion The"efficacy component group",main targets and signaling pathways predicted in this study can provide support for the research on the mechanism,material basis and quality control of the alcohol detoxification and liver protection effects of Puerariae Lobatue Radix.
