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通过转录组学数据和综合生物信息学分析解码微藻衍生生物活性化合物的分子机制

Decoding the Molecular Mechanism of Bioactive Compounds Derived from Microalgae via Transcriptomics Data and Integrative Bioinformatics Analysis.

作者信息

Shahid Hina, Ibrahim Muhammad, Alonazi Wadi B, Chi Zhanyou

机构信息

MOE Key Laboratory of Bio-Intelligent Manufacturing, School of Bioengineering, Dalian University of Technology, Dalian, Liaoning, China.

Institute of Biotechnology, College of Agriculture and Biotechnology, Zhejiang University, Hangzhou, P.R. China.

出版信息

Curr Comput Aided Drug Des. 2025 Jul 24. doi: 10.2174/0115734099389525250704104200.

Abstract

INTRODUCTION

Microalgae, with their high photosynthetic efficiency and sustainability, hold promise to produce bioactive compounds, chemicals, cosmetics, and biofuels. This study aims to understand the molecular mechanisms of bioactive compounds from microalgae using integrative bioinformatics approaches to identify their potential therapeutic applications.

METHODS

Gene expression profiles from the GSE113144 and GSE115827 datasets were retrieved from the GEO database using keywords such as liver disease, microalgae, and bioactive compounds. Different expressed genes (DEGs) were identified using the GEO2R tool. Subsequently, a PPI network was constructed to identify hub genes and key regulatory elements. The findings were further cross-validated using a range of bioinformatics tools, databases, and literature to explore their potential applications in drug development, nutraceuticals, and disease modulation.

RESULTS

Following oxo-fatty acid treatment, 2051 differentially expressed genes (DEGs) were identified, while 399 DEGs were detected after sea spray aerosol treatment, with 39 genes shared between the two treatments. These DEGs were primarily enriched in immune and metabolic processes. Protein-protein interaction analysis revealed ten key hub genes: PBK, CENPA, ASPM, DLGAP5, DEPDC1, SPC25, CDCA3, HJURP, ERCC6L, and KIF18B, which are involved in immune and metabolic responses. Functional enrichment highlighted roles in cholesterol and fatty-acyl-CoA binding, peptidoglycan recognition, metal ion binding, and protease activity. Notably, PBK and CDCA3 are associated with approved drugs, suggesting potential for therapeutic repurposing.

DISCUSSION

The molecular functions enriched among hub genes, such as cholesterol binding, fatty-acyl-CoA binding, peptidoglycan receptor activity, and metal ion binding, suggest actionable pathways that could be pharmacologically modulated. These targets are highly relevant to diseases such as NAFLD and chronic inflammation. The identification of druggable hub genes and enriched immune-metabolic functions provides a foundation for further preclinical and translational research.

CONCLUSION

This study offers valuable insights into the molecular mechanisms underlying human immune and metabolic responses to sea spray aerosols and oxo-fatty acids, identifying cellular pathways and processes that are often regulated in human immune and metabolic responses to various microalgae. Overall, this study enhances our understanding of the potential therapeutic applications of microalgae-derived bioactive compounds, offering potential breakthroughs in drug discovery and nutraceutical development.

摘要

引言

微藻具有高光合效率和可持续性,有望生产生物活性化合物、化学品、化妆品和生物燃料。本研究旨在利用综合生物信息学方法了解微藻生物活性化合物的分子机制,以确定其潜在的治疗应用。

方法

使用诸如肝病、微藻和生物活性化合物等关键词从基因表达综合数据库(GEO)中检索GSE113144和GSE115827数据集的基因表达谱。使用GEO2R工具鉴定差异表达基因(DEG)。随后,构建蛋白质-蛋白质相互作用(PPI)网络以识别枢纽基因和关键调控元件。使用一系列生物信息学工具、数据库和文献对研究结果进行进一步交叉验证,以探索它们在药物开发、营养保健品和疾病调节中的潜在应用。

结果

在氧代脂肪酸处理后,鉴定出2051个差异表达基因,而在海浪气溶胶处理后检测到399个差异表达基因,两种处理之间共有39个基因相同。这些差异表达基因主要富集于免疫和代谢过程。蛋白质-蛋白质相互作用分析揭示了十个关键枢纽基因:PBK、CENPA、ASPM、DLGAP5、DEPDC1、SPC25、CDCA3、HJURP、ERCC6L和KIF18B,它们参与免疫和代谢反应。功能富集突出了在胆固醇和脂肪酰辅酶A结合、肽聚糖识别、金属离子结合和蛋白酶活性方面的作用。值得注意的是,PBK和CDCA3与已批准的药物相关,表明具有治疗性重新利用的潜力。

讨论

枢纽基因中富集的分子功能,如胆固醇结合、脂肪酰辅酶A结合、肽聚糖受体活性和金属离子结合,表明了可通过药理学调节的可行途径。这些靶点与非酒精性脂肪性肝病和慢性炎症等疾病高度相关。可成药枢纽基因的鉴定和富集的免疫代谢功能为进一步的临床前和转化研究提供了基础。

结论

本研究为人类对海浪气溶胶和氧代脂肪酸的免疫和代谢反应的分子机制提供了有价值的见解,确定了在人类对各种微藻的免疫和代谢反应中经常受到调节的细胞途径和过程。总体而言,本研究增进了我们对微藻衍生生物活性化合物潜在治疗应用的理解,为药物发现和营养保健品开发提供了潜在突破。

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