庄莉, 翟园园, 姚卫峰, 徐佳, 冯丽, 包贝华, 曹雨诞, 张丽, 丁安伟. 基于网络药理学的二至丸对肾脏保护作用的机制研究J. 药学学报, 2019,54(5): 877-885. doi: 10.16438/j.0513-4870.2018-0993
引用本文: 庄莉, 翟园园, 姚卫峰, 徐佳, 冯丽, 包贝华, 曹雨诞, 张丽, 丁安伟. 基于网络药理学的二至丸对肾脏保护作用的机制研究J. 药学学报, 2019,54(5): 877-885. doi: 10.16438/j.0513-4870.2018-0993
ZHUANG Li, ZHAI Yuan-yuan, YAO Wei-feng, XU Jia, FENG Li, BAO Bei-hua, CAO Yu-dan, ZHANG Li, DING An-wei. The mechanism study of protecting kidney of Erzhi Pill based on network pharmacologyJ. Acta Pharmaceutica Sinica, 2019,54(5): 877-885. doi: 10.16438/j.0513-4870.2018-0993
Citation: ZHUANG Li, ZHAI Yuan-yuan, YAO Wei-feng, XU Jia, FENG Li, BAO Bei-hua, CAO Yu-dan, ZHANG Li, DING An-wei. The mechanism study of protecting kidney of Erzhi Pill based on network pharmacologyJ. Acta Pharmaceutica Sinica, 2019,54(5): 877-885. doi: 10.16438/j.0513-4870.2018-0993

基于网络药理学的二至丸对肾脏保护作用的机制研究

The mechanism study of protecting kidney of Erzhi Pill based on network pharmacology

  • 摘要: 采用网络药理学方法,基于反向药效团匹配的靶标识别服务平台,预测已有文献报道的二至丸保护肾脏药效成分的靶点,采用分子对接对靶点基因进行筛选分析,通过生物学信息注释数据库(DAVID)对靶点基因进行生物学过程及代谢通路分析,采用Cytoscape软件构建二至丸保护肾脏"成分-靶点-通路"网络。通过将上述靶点与疾病靶点数据库TTD和GAD筛选得到的肾损伤相关靶点进行比对筛选,进一步构建"成分-核心靶点"网络。结果显示,二至丸中17个保护肾脏的活性成分可能通过调控ESR1、ESR2、GCK和MMP3等32个靶标,干预PI3K-Akt信号通路、雌激素信号通路和嘌呤代谢过程等6条途径起到保护肾脏的作用。本研究体现了中药多成分、多靶点和多途径的作用特点,为复方二至丸保护肾脏作用机制的解释提供新的思路和线索。

     

    Abstract: Based on the concept of network pharmacology, the main nephroprotective components in Erzhi Pill reported in previous studies, were used to predict the targets through the PharmMapper method. Molecular docking was applied to screen for potential targets and biological information annotation databases (DAVID) was used to analyze the molecular function and biological process of the action targets. The Cytoscape software was used to construct the "ingredient-target-pathway" network of Erzhi Pill for renal injury treatment. TTD and GAD database were then applied to screen for the targets of renal disease for building "ingredient-core target" network. We found that 17 major active ingredients of Erzhi Pill regulated 32 targets (including ESR1, ESR2, GCK, MMP3) and affected 6 pathways, such as PI3K-Akt signaling pathway, estrogen signaling pathway and purine metabolism. This study reflected the nature of traditional Chinese medicine as multi-ingredients, multi-targets and multi-path ways, providing new clues for basic science research on the nephroprotective pharmacological mechanism of Erzhi Pill.

     

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