利用数据挖掘和网络药理学方法,对含刺五加保健品的配方规律和增强免疫功能进行了分析

Meiyue Li, Pei Ma, Xue Li, Lijia Xu, Lifeng Yue
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引用次数: 0

摘要

目的分析刺五加保健品的配方规律,探讨其可能的作用机制。方法通过国家市场监督管理总局食品信息专项查询平台和医药科学网对含磁五加保健品进行检索,利用R语言软件包和Excel软件对其功效、味向、剂型、保健功能等基本信息进行分析。采用IBM SPSS Modeler 18.0的Apriori算法对处方规则和核心药物组合进行分析。通过检索TCMID等数据库并查阅相关文献,构建刺五加的化学成分及潜在靶点数据库。利用R软件包、String数据库和Cytoscape软件分析蛋白-蛋白相互作用网络,筛选与健康功能相关的关键组分和靶点。进行了基因本体功能标注和京都百科全书基因和基因组路径富集分析。最后通过分子对接验证核心靶点与关键组分的结合亲和力。结果共收集到含刺五加保健品315例。主要的保健功能是缓解身体疲劳和增强免疫力。共获得刺五加有效成分205个,相关靶点775个。通过对刺五加与免疫增强相关基因的交叉分析,鉴定出212个关键靶基因。刺五加通过c型凝集素受体、toll样受体、nod样受体等信号通路发挥免疫增强作用。分子对接结果也表明刺五加的关键成分与核心靶点之间存在自发、稳定的结合。本研究通过数据挖掘、网络药理学、分子对接等研究方法,对含刺五加保健品的相关信息进行分析,初步揭示其潜在的免疫增强靶点和机制途径,为未来保健品的开发提供理论依据。
本文章由计算机程序翻译,如有差异,请以英文原文为准。

Utilizing data mining and network pharmacology to analyze the formulation rule and function of enhancing immunity of Acanthopanax Radix et Rhizoma-containing health products

Utilizing data mining and network pharmacology to analyze the formulation rule and function of enhancing immunity of Acanthopanax Radix et Rhizoma-containing health products

Objective

This study aims to analyze the formulation rules of Ciwujia (Acanthopanax Radix et Rhizoma)-containing health products and investigate the potential mechanisms.

Methods

By searching the Ciwujia-containing health products from the special food information inquiry platform of the State Administration for Market Regulation and MedSciNet, the basic information, including efficacy, tropism of taste, dosage form, health function etc., was analyzed using R language software packages and Excel. The formulation rules and core drug combinations were analyzed using the Apriori algorithm of IBM SPSS Modeler 18.0. By searching TCMID and other databases and reviewing relevant literature, the chemical components and potential targets database of Ciwujia was constructed. The protein–protein interaction network was analyzed using R package, String database, and Cytoscape software to screen for key components and targets related to health functions. Gene ontology functional annotation and Kyoto encyclopedia of genes and genomes pathway enrichment analysis were performed. Finally, molecular docking was used to verify the binding affinity of core targets and key components.

Results

A total of 315 cases of Ciwujia-containing health products were collected. The major health functions were to relieve physical fatigue and immune enhancement. A total of 205 effective components and 775 targets related to Ciwujia were obtained. By intersecting the genes related to Ciwujia and immune enhancement, 212 key target genes were identified. Ciwujia has an effect on immune enhancement through signaling pathways such as C-type lectin receptor, toll-like receptor, and NOD-like receptor. Molecular docking results also indicated a spontaneous and stable binding between the key components of Ciwujia and the core targets.

Conclusions

Through data mining, network pharmacology, and molecular docking research, this study analyzed the relevant information of Ciwujia-containing health products, preliminarily revealing its potential targets and mechanism pathways of immune enhancement and providing a theoretical basis for the development of future health products.

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