通过结合网络药理学和分子对接技术的综合方法,评估月桂酸在口腔癌方面的作用机制。

Q2 Medicine
Journal of Complementary and Integrative Medicine Pub Date : 2024-02-05 eCollection Date: 2024-03-01 DOI:10.1515/jcim-2023-0262
Kirti Buva, Gauri M Kumbhar, Ajinkya Deshmukh, Vaibhav Sunil Ladke
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引用次数: 0

摘要

研究目的人们一直在研究月桂酸对各种人类癌细胞类型的影响,但专门针对其对口腔癌影响的研究却很有限。有鉴于此,我们的研究旨在全面评估月桂酸的抗癌特性,特别是在口腔癌方面。这一评估是通过利用网络分析技术的硅内法实现的。通过采用这种方法,我们旨在深入了解月桂酸治疗口腔癌的潜在疗效:硅内分析包括药物相似性预测、口腔癌与月桂酸共同靶点预测、蛋白-蛋白相互作用(PPI)、枢纽基因、基因本体(GO)前 10 个相关通路、京都基因组百科全书(KEGG)通路、分子对接实验:结果:我们的研究发现了 23 个参与细胞增殖、凋亡调控、PI3K AKT 级联和细胞周期控制等关键细胞过程的常见基因。其中,CXCL8、MMP9、PPARA、MAPK1 和 AR 在前 10 个通路中脱颖而出,尤其是在 PI3K/AKT 信号通路中。这凸显了月桂酸通过PI3K/AKT通路在口腔癌治疗中的潜在作用,并呼吁进一步探索这一机制:我们的研究通过计算分析强调了月桂酸的抗癌特性,为今后的癌症治疗开发研究奠定了基础。这种方法将分子洞察力与室内方法相结合,为确定治疗化合物并了解其机制铺平了道路。月桂酸具有作为化疗药物的潜力,为癌症治疗探索开辟了新途径。
本文章由计算机程序翻译,如有差异,请以英文原文为准。
The assessment of the mechanism of action of lauric acid in the context of oral cancer through integrative approach combining network pharmacology and molecular docking technology.

Objectives: Lauric acid has been investigated for its effects on various human cancer cell types, although limited research has been dedicated to its impact on oral cancer. In light of this, the objective of our study was to comprehensively assess the anticancer properties of lauric acid specifically in the context of oral cancer. This evaluation was achieved through an in-silico approach, leveraging network analysis techniques. By employing this methodology, we aimed to gain valuable insights into the potential therapeutic benefits of lauric acid for treating oral cancer.

Methods: The in-silico analysis involved determination of drug-likeness prediction, prediction of common targets between oral cancer and LA, protein-protein interactions (PPI), hub genes, top 10 associated pathways by gene ontology (GO), Kyoto Encyclopaedia of Genes and Genomes (KEGG) pathway, molecular docking experiments.

Results: Our study pinpointed 23 common genes involved in critical cellular processes, including proliferation, apoptosis regulation, PI3K AKT cascade, and cell cycle control. Among them, CXCL8, MMP9, PPARA, MAPK1, and AR stood out in the top 10 pathways, particularly in the PI3K/AKT signaling pathway. This highlights the potential role of lauric acid in oral cancer treatment through the PI3K/AKT pathway and calls for further exploration of this mechanism.

Conclusions: Our study highlights lauric acid's promising anticancer properties through computational analysis, offering a foundation for future research in cancer treatment development. This approach combines molecular insights with in-silico methods, paving the way for identifying therapeutic compounds and understanding their mechanisms. Lauric acid holds potential as a chemotherapeutic agent, opening up new avenues for cancer therapy exploration.

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来源期刊
Journal of Complementary and Integrative Medicine
Journal of Complementary and Integrative Medicine Medicine-Complementary and Alternative Medicine
CiteScore
3.10
自引率
0.00%
发文量
51
期刊介绍: Journal of Complementary and Integrative Medicine (JCIM) focuses on evidence concerning the efficacy and safety of complementary medical (CM) whole systems, practices, interventions and natural health products, including herbal and traditional medicines. The journal is edited by Ed Lui of the University of Western Ontario. Topics: -Quality, efficacy, and safety of natural health products, dietary supplements, traditional medicines and their synthetic duplicates -Efficacy and safety of complementary therapies -Evidence-based medicine and practice, including evidence of traditional use -Curriculum development, educational system and competency of complementary health programs -Methodologies on research and evaluation of traditional medicines and herbal products -Integrative medicine: basic and clinical research and practice -Innovation in CAM Curriculum -Educational Material Design
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