基于网络药理学、指纹图谱和体外实验的九味姜汤口服液药效物质与质量控制研究

IF 1.5 4区 医学 Q4 CHEMISTRY, MEDICINAL Natural Product Communications Pub Date : 2024-09-03 DOI:10.1177/1934578x241280871
Qian Li, Jingnan Pei, Li Wang, Jinsha Li, Danjian Qin, Huining Mo, Hongping Zhang
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引用次数: 0

摘要

研究目的本研究旨在探讨九味姜汤口服液(JWJT)的指纹图谱和质量控制指标成分,九味姜汤口服液以其对 2 型糖尿病(T2DM)的治疗效果而著称。研究方法本研究采用网络药理学和分子对接技术筛选九味姜汤口服液的核心成分、核心靶点和作用通路。此外,还建立了12批JWJT的高效液相色谱指纹图谱。利用化学计量学方法对 12 个批次的 JWJT 进行了评估,并通过相似性评估确定了共同峰。通过评估 JWJT 拮抗胰岛素的 HepG2 细胞对葡萄糖消耗的控制能力及其对α-葡萄糖苷酶的抑制活性,筛选出有效物质来验证 JWJT 的指标成分。结果:通过网络药理学和分子对接分析,发现葛根素、萼苷、鞣花酸、山奈酚-3-O-芸香糖苷和山奈酚是 JWJT 治疗 T2DM 的核心成分。在治疗 T2DM 的过程中,AKT1、PIK3R1、INSR、TNF 和 EGFR 等关键靶点与 HIF-1、MAPK 和 PI3K-Akt 等调节途径有关。12 批 JWJT 样品的高效液相色谱指纹图谱显示出 10 个常见峰,其中葛根素、萼苷、鞣花酸和山奈酚-3-O-芸香糖苷在 4 个色谱峰中被特别识别。通过化学模式识别,样品被分为两组,葛根素、萼苷和鞣花酸被确定为差异标记物。通过胰岛素抗性 HepG2 细胞的葡萄糖消耗量和α-葡萄糖苷酶抑制活性的验证,证实葛根素、花萼苷和鞣花酸是适合作为 JWJT 质量控制指标的有效成分。结论本研究建立的 JWJT 指纹法既简单又具有可重复性。所选择的指标成分将作为 JWJT 质量控制的依据,并为选择和验证治疗 T2DM 的 JWJT 质量指标成分提供了一种新方法。
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Study on Pharmacodynamic Substances and Quality Control of Jiuwei Jiangtang Oral Liquid Based on Network Pharmacology, Fingerprint and In Vitro Experiment
Objective: This study aims to explore the fingerprint and quality control index components of Jiuwei Jiangtang Oral Liquid (JWJT), known for its therapeutic effects on type 2 diabetes mellitus (T2DM). Methods: This study employed network pharmacology and molecular docking to screen the core components, core targets, and pathways of JWJT. Additionally, HPLC fingerprint was established for 12 batches of JWJT. 12 batches of JWJT were evaluated using stoichiometry and common peaks were determined following a similarity assessment. The effective substances were selected to verify the index components of JWJT through assessing their control over glucose consumption in insulin-resistant HepG2 cells and their α-glucosidase inhibitory activity. Results: Through network pharmacology and molecular docking analysis, puerarin, calycosin, ellagic acid, kaempferol-3-O-rutinoside, and kaempferol were identified as core components of JWJT for treating T2DM. Key targets such as AKT1, PIK3R1, INSR, TNF, and EGFR were implicated in regulating pathways including HIF-1, MAPK, and PI3K-Akt in T2DM treatment. The HPLC fingerprints of 12 batches of JWJT samples revealed 10 common peaks, with puerarin, calycosin, ellagic acid, and kaempferol-3-O-rutinoside specifically identified among 4 chromatographic peaks. Using chemical pattern recognition, samples were categorized into two groups, with puerarin, calycosin, and ellagic acid identified as differential markers. Verification through glucose consumption in insulin-resistant HepG2 cells and α-glucosidase inhibitory activity confirmed that puerarin, calycosin, and ellagic acid were active ingredients suitable as quality control indicators for JWJT. Conclusion: The JWJT fingerprint method established in this study is both simple and reproducible. The selected index components will serve as the basis for quality control of JWJT and introduce a novel approach for selecting and verifying quality index components of JWJT in T2DM treatment.
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来源期刊
Natural Product Communications
Natural Product Communications 工程技术-食品科技
CiteScore
3.10
自引率
11.10%
发文量
254
审稿时长
2.7 months
期刊介绍: Natural Product Communications is a peer reviewed, open access journal studying all aspects of natural products, including isolation, characterization, spectroscopic properties, biological activities, synthesis, structure-activity, biotransformation, biosynthesis, tissue culture and fermentation. It covers the full breadth of chemistry, biochemistry, biotechnology, pharmacology, and chemical ecology of natural products. Natural Product Communications is a peer reviewed, open access journal studying all aspects of natural products, including isolation, characterization, spectroscopic properties, biological activities, synthesis, structure-activity, biotransformation, biosynthesis, tissue culture and fermentation. It covers the full breadth of chemistry, biochemistry, biotechnology, pharmacology, and chemical ecology of natural products. Natural Product Communications is a peer reviewed, open access journal studying all aspects of natural products, including isolation, characterization, spectroscopic properties, biological activities, synthesis, structure-activity, biotransformation, biosynthesis, tissue culture and fermentation. It covers the full breadth of chemistry, biochemistry, biotechnology, pharmacology, and chemical ecology of natural products.
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