Integrated metabolomic, network pharmacological, and molecular docking analyses comparing the therapeutic effects of Strobilanthes sarcorrhiza from different origins

整合代谢组学、网络药理学和分子对接分析,比较不同来源的马蓝根的治疗效果

阅读:3

Abstract

Strobilanthes sarcorrhiza, a characteristic medicinal plant in China, has been traditionally used for nourishing yin and tonifying kidneys through its fleshy roots. However, the lack of clarity regarding its key active components and mechanisms has hindered its comprehensive development. We collected two geographical provenances (YJ and GL) through resource investigation, and compared the differences between two origins through phenotype determination, metabolomics analysis, network pharmacology analysis, and molecular docking experiments. The YJ plants had higher plant height and heavier roots compared to GL plants, while the roots of GL contained higher levels of total flavonoids and phenolic contents. Untargeted metabolomics demonstrated that Daidzein, Isosakuranetin, Apigenin, and Vindoline might be the metabolites predominantly accumulated in the YJ provenance; conversely, Sinensetin, Tangeritin, Vitexin, Phlorizin, and Dopamine might display specific enrichment in the GL provenance. Integrated network pharmacology and molecular docking analyses elucidated that the high-content Apigenin and Vindoline in YJ provenance exhibited nephritis therapeutic potential through targeted binding to EGFR. Conversely, the GL-enriched Sinensetin and Tangeritin demonstrated analgesic effects via SRC interaction, providing mechanistic insights into their dentalgia alleviating properties. This study comprehensively analyzed the quality differences between two origins of S. sarcorrhiza, which systematically elucidates the material basis and molecular mechanisms underlying the pharmacological activities of S. sarcorrhiza, offering scientific support for resource utilization and germplasm improvement. SUPPLEMENTARY INFORMATION: The online version contains supplementary material available at 10.1038/s41598-026-44698-9.

特别声明

1、本页面内容包含部分的内容是基于公开信息的合理引用;引用内容仅为补充信息,不代表本站立场。

2、若认为本页面引用内容涉及侵权,请及时与本站联系,我们将第一时间处理。

3、其他媒体/个人如需使用本页面原创内容,需注明“来源:[生知库]”并获得授权;使用引用内容的,需自行联系原作者获得许可。

4、投稿及合作请联系:info@biocloudy.com。