天然产物研究与开发 ›› 2022, Vol. 34 ›› Issue (5): 864-873.doi: 10.16333/j.1001-6880.2022.5.016

• 数据研究 • 上一篇    下一篇

基于网络药理学和指纹图谱的一枝蒿抗乙肝病毒质量标志物预测分析

毛   艳1，刘荣昌2，丁   曼1，贺金华1*   

  1. 1新疆维吾尔自治区药物研究所，乌鲁木齐 830004；2新疆医科大学药学院，乌鲁木齐 830011
  • 出版日期:2022-05-28 发布日期:2022-05-23
  • 基金资助:
    新疆维吾尔自治区卫生健康青年医学科技人才专项（WJWY-201961）；新疆维吾尔自治区自然科学基金-杰出青年（2021D01E25）

Anti-HBV Q-Marker prediction analysis of Artemisia rupestris L. based on network pharmacology and fingerprint

MAO Yan1,LIU Rong-chang2,DING Man1,HE Jin-hua1*   

  1. 1Xinjiang Institute of Materia Medica,Urumqi 830004,China;2College of Pharmacy,Xinjiang Medical University,Urumqi 830054,China
  • Online:2022-05-28 Published:2022-05-23

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摘要： 利用网络药理学和指纹图谱预测分析一枝蒿Artemisia rupestris L.抗乙肝病毒的潜在质量标志物（Q-Marker）。采用网络药理学方法构建“活性成分-靶点-通路”网络，筛选和分析一枝蒿的相关靶点和通路，采用高效液相色谱法建立一枝蒿药材指纹图谱，用正交偏最小二乘法判别分析（OPLS-DA）筛选组间差异性成分，综合预测一枝蒿Q-Marker。结果表明，网络药理学分析得到潜在的15个活性成分，18批一枝蒿HPLC指纹图谱共有18个共有峰，通过对照品比对指认了8个共有峰，分别为绿原酸、芦丁、蒙花苷、木犀草素、一枝蒿酮酸、芹菜素、蔓荆子黄素和洋艾素，综合分析初步预测一枝蒿酮酸、蒙花苷、芹菜素和木犀草素为一枝蒿潜在的Q-marker。一枝蒿Q-Marker预测分析为药材质量评价提供参考，为阐明其药效物质基础及作用机制奠定基础。

关键词: 一枝蒿, 质量标志物, 指纹图谱, 网络药理学

Abstract:

To predict and analyze potential anti-hepatitis B virus quality marker (Q-Marker) of Artemisia rupestris L. based on network pharmacology and fingerprint.Network pharmacology was used to construct a “compound-target-pathway” network to screen and analyze the relevant targets and pathways of A. rupestris.The fingerprints of 18 batches of A. rupestris were established by using HPLC method.OPLS-DA was used to screen out the main components that cause differences between groups,comprehensive prediction Q-Marker of  A. rupestris.Fifteen potential active ingredients were obtained by network pharmacological analysis.Fingerprints of 18 batches of  A. rupestris were established,8 common peaks (chlorogenic acid,rutinum,buddleoside,luteolin,rupestonic acid,apigenin,casticin,absinthin) were identified by standard substance.Finally,based on the concept of Q-Marker and multiple considerations,artemisinic acid,buddleoside,apigenin,and luteolin can be preliminarily potential Q-Markers of  A. rupestris. The Q-Marker predictive analysis of  A. rupestris provides a reference for the quality evaluation of medicinal materials and lays the foundation for clarifying the mechanism of action of its medicinal material basis.

Key words: Artemisia rupestris L., quality marker (Q-Marker), fingerprint, network pharmacology

中图分类号:  R917

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