广西林业科学2026，Vol.55Issue(3)：289-296,8.DOI:10.19692/j.issn.1006-1126.20260308
基于网络药理学与分子对接分析王百合苷干预抑郁症分子机制
Analysis on Molecular Mechanisms of Regalosides in Depression Intervention Based on Network Pharmacology and Molecular Docking
摘要
Abstract
In order to investigate molecular mechanisms of Cardiocrinum giganteum in dpression intervention,taking C.giganteum bulbs as material basis and Regaloside A,Regaloside B and Regaloside F as ligands,C.gi-ganteum active compound targets and related targets with depression and neurodegenerative diseases were screened from databases.Mutual targets were obtained by intersection operation between gene set for active compound targets and gene set for disease related targets.Protein-protein interaction(PPI)network was con-structed to screen core targets by evaluation of topological characteristics.Gene Ontology(GO)function annota-tion and KEGG pathway enrichment analysis were performed.Molecular docking was employed to verify bind-ing activities among active compounds and core targets.Results showed that a total of 94 mutual targets were obtained.ALB,SRC,CASP3,TLR4,MAPK14 and HSP90AA1 were core targets.Pharmacological effects of C.giganteum active compounds primarily involved regulation of stress responses,maintenance of neuronal homeo-stasis,serotoninergic synapses,MAPK signaling pathway and apoptosis pathway.Regalosides A,B and F exhib-ited strong binding activities with proteins of MAPK14,CASP3 and HSP90AA1.C.giganteum exerted synergis-tic anti-depressant effects through multi-active compounds,multi-targets and multi-pathways,with mecha-nism might closely relating to modulating neurotransmission,suppressing inflammation and inhibiting neuronal apoptosis.关键词
王百合苷/抑郁症/网络药理学/分子对接/大百合Key words
regaloside/depression/network pharmacology/molecular docking/Cardiocrinum giganteum分类
医药卫生引用本文复制引用
李荣琛,黄丽芸,黄晓露,廖健明,刘晓东,赵志珩,李珏..基于网络药理学与分子对接分析王百合苷干预抑郁症分子机制[J].广西林业科学,2026,55(3):289-296,8.基金项目
"垒台"行动计划(广西科技创新平台计划)特色林下药材资源发掘创新及应用示范(桂科LT2504240030) （广西科技创新平台计划）
北京市职业病防治院院长基金(YZJJ2025001) （YZJJ2025001）
广西特色经济林培育与利用重点实验室自主课题(JA-24-04-01) （JA-24-04-01）
广西林业科技推广示范项目(2023GXLK21) （2023GXLK21）
