首页|利用指纹图谱和网络药理学预测牵牛子抗炎Q-marker

利用指纹图谱和网络药理学预测牵牛子抗炎Q-marker

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通过UPLC建立了牵牛子的指纹图谱,并测定了主要抗炎成分的含量.通过网络药理学方法,构建了"成分-靶点-通路"网络,分子对接验证了Q-marker的生物活性,并通过RAW264.7 细胞实验验证了抗炎活性.建立了16批牵牛子的指纹图谱,指认出7个共有色谱峰:绿原酸、新绿原酸、咖啡酸、异槲皮苷和异绿原酸A、B、C;经网络药理学分析,筛选出7个成分的32个核心靶点和6条关键通路;分子对接配体与受体有较强结合能力;一氧化氮(NO)抑制率结果阐明了牵牛子提取物以及7个成分均有抗炎活性.结果表明:绿原酸、新绿原酸、咖啡酸、异槲皮苷和异绿原酸A、B、C可作为牵牛子的潜在抗炎Q-marker,为牵牛子的质量控制以及合理应用提供依据.
Prediction of the anti-inflammatory Q-marker of Pharbitidis Semen based on fingerprint and network pharmacology
The fingerprint of Pharbitidis Semen was established by UPLC,and the main anti-inflammatory components were determined.Then,the network of"component-target-pathway"was constructed through the network pharmacology method,and molecular docking verifies the biological activity of Q-marker,and through the RAW264.7 cell experiment to verify the anti-inflammatory activity.16 batches of Pharbitidis Semen fingerprints were established,and 7 chromatographic peaks were identified,which were neochlorogenic acid,chlorogenic acid,caffeic acid,isoquercitrin,and isochlorogenic acid A,B&C.According to network pharmacology analysis,32 core targets and 6 key pathways of 7 chemical components were screened.Molecular docking ligands have strong binding ability to receptors.The results of NO inhibition rate clarified that the extract of Pharbitidis Semen and the 7 components have anti-inflammatory activity.Conclusion:Chlorogenic acid,neochlorogenic acid,caffeic acid,isoquercitrin,and isochlorogenic acid A,B&C are potential anti-inflammatory Q-markers of Pharbitidis Semen,which can provide the theoretical basis for its quality control and rational application.

Pharbitidis SemenQ-markerfingerprintchlorogenic acidcaffeic acidanti-inflammatory

李娟、彭洪兵、向玉林、刘雪年、孙媛、詹志来

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湖北中医药大学 药学院,武汉 430065

中国中医科学院 中药资源中心/道地药材国家重点实验室培育基地, 北京 100007

牵牛子 Q-marker 指纹图谱 绿原酸 咖啡酸 抗炎

中央本级重大增减支项目

2060302-1906-06

2024

中南民族大学学报(自然科学版)
中南民族大学

中南民族大学学报(自然科学版)

影响因子:0.536
ISSN:1672-4321
年,卷(期):2024.43(1)
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