Exploring the Mechanisms of Action of Quercetin for the Treatment of Cervical High-Risk-Human Papilloma Virus Using Network Pharmacology and Molecular Docking

Shanyun Wang, Huisi Hong, Yiming Yuan, Yinhao Yin, Jianfeng Zeng, Jing Xiao
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Abstract

Objective Our objective was to investigate the therapeutic mechanism of quercetin in the management of cervical HR-HPV through the integration of network pharmacology and molecular docking techniques. Methods The GeneCard database was utilized to analyze and identify potential therapeutic targets in HR-HPV. Subsequently, a protein–protein interaction (PPI) network was constructed by employing the String database. The visualization and construction of PPI networks were accomplished using Cytoscape. The R language was utilized to conduct Gene Ontology (GO) enrichment and Kyoto Encyclopedia of Genes and Genomes (KEGG) pathway analyses. Results A total of 154 active constituents of quercetin were identified through screening. Additionally, 139 target genes associated with the effects of quercetin on cervical HR-HPV were predicted. PPI analyses revealed that threonine kinase Akt1, mitogen-activated protein kinase1, human IL-6 protein, signal transducer and activator of transcription 3, and epidermal growth factor receptor (EGFR) may serve as potential targets for quercetin in the treatment of cervical HR-HPV. Furthermore, GO and KEGG analyses demonstrated that quercetin is involved in various functional pathways, biological processes, molecular categories, including the Th17 signaling pathway, tumor necrotizing factor (TNF) signaling pathway, EGFR signaling pathway, PI3K-Akt signaling pathway, among others. Conclusion Quercetin exhibits multifaceted characteristics, targeting multiple components, pathways, and targets, in the therapeutic intervention of HR-HPV, primarily by modulating inflammatory responses, oxidation reactions, and apoptotic processes.
利用网络药理学和分子对接探索槲皮素治疗宫颈高危型人类乳头瘤病毒的作用机制
目的 通过整合网络药理学和分子对接技术,研究槲皮素治疗宫颈 HR-HPV 的机制。方法 利用 GeneCard 数据库分析并确定 HR-HPV 的潜在治疗靶点。随后,利用 String 数据库构建了蛋白质-蛋白质相互作用(PPI)网络。PPI网络的可视化和构建是通过Cytoscape完成的。利用 R 语言进行了基因本体(GO)富集和京都基因和基因组百科全书(KEGG)通路分析。结果 通过筛选,共鉴定出 154 种槲皮素活性成分。此外,还预测了 139 个与槲皮素对宫颈 HR-HPV 影响相关的靶基因。PPI分析表明,苏氨酸激酶Akt1、丝裂原活化蛋白激酶1、人IL-6蛋白、信号转导和激活转录3以及表皮生长因子受体(EGFR)可能是槲皮素治疗宫颈HR-HPV的潜在靶点。此外,GO 和 KEGG 分析表明,槲皮素参与了多种功能通路、生物过程和分子类别,包括 Th17 信号通路、肿瘤坏死因子(TNF)信号通路、表皮生长因子受体(EGFR)信号通路、PI3K-Akt 信号通路等。结论 槲皮素主要通过调节炎症反应、氧化反应和细胞凋亡过程,在对 HR-HPV 的治疗干预中表现出针对多种成分、途径和靶点的多方面特性。
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