研究姜黄素阻断与乳腺癌相关的白细胞介素-8 信号通路的机理:一种内模拟方法

IF 4.4 2区 生物学 Q1 Agricultural and Biological Sciences Saudi Journal of Biological Sciences Pub Date : 2024-05-31 DOI:10.1016/j.sjbs.2024.104035
Bader S. Alotaibi , Mohammed Ageeli Hakami , Ali Hazazi , Ahad Amer Alsaiari , Mohammad Khalid , Anam Beg
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引用次数: 0

摘要

白细胞介素-8(IL-8)是一种趋化因子,是一种在免疫反应和炎症中发挥作用的信号分子。近年来,IL-8 还与癌症的生长和复发有关。乳腺癌的生长、恶化和转移都与 IL-8 有关。众所周知,当 IL-8 刺激乳腺癌细胞的增殖和存活时,它们会发展得更快。它还能导致血管生成,即生成新的血管,这是肿瘤营养和生长所必需的。IL-8和姜黄素一直是药物设计中备受关注的主题,尤其是在与炎症相关的疾病和癌症方面。本研究旨在概述 IL-8 的作用。目前正在使用基于抑制剂的治疗方法,用姜黄素来靶向IL-8。本研究采用分子对接法寻找潜在的相互作用,以抑制姜黄素对IL-8的竞争性抑制。此外,还进行了PASS分析和ADMET特征分析。最终,IL-8与姜黄素的复合物被选中进行MD模拟。总之,我们的结果表明,在模拟过程中,复合物保持相对稳定。我们还可以将姜黄素作为一种可能的治疗方案进行进一步研究。综合结果表明,IL-8 及其基因改变可在癌症精准治疗中进行研究,利用靶向驱动疗法和早期诊断。
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Investigating mechanistic insights of curcumin in blocking the Interleukin-8 signaling pathway associated with Breast Cancer: An in-silico approach

Interleukin-8 (IL-8) is a chemokine, a type of signaling molecule that has a role in immunological responses and inflammation. In recent years, IL-8 is additionally related to cancer growth and recurrence. Breast cancer growth, progression, and metastatic development are all linked to IL-8. Breast cancer cells are known to develop faster when IL-8 stimulates their proliferation and survival. It can also cause angiogenesis, or the creation of new blood vessels, which is necessary for tumor nutrition and growth. IL-8 and curcumin have been subjects of interest in drug design, particularly in the context of inflammation-related disorders and cancer. This study aims to give an overview of the role of IL-8. Inhibitor-based treatment approaches were being used to target IL-8 with curcumin. Molecular docking method was employed to find a potential interaction to supress competitive inhibition of IL-8 with curcumin. PASS analysis and ADMET characteristics were also being carried out. In the end, IL-8 complexed with curcumin is chosen for MD simulations. Overall, our results showed that during the simulation, the complex stayed comparatively stable. It is also possible to investigate curcumin further as a possible treatment option. The combined results imply that IL-8 and their genetic alterations can be studied in precision cancer therapeutic treatments, utilizing target-driven therapy and early diagnosis.

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来源期刊
CiteScore
9.30
自引率
4.50%
发文量
551
审稿时长
34 days
期刊介绍: Saudi Journal of Biological Sciences is an English language, peer-reviewed scholarly publication in the area of biological sciences. Saudi Journal of Biological Sciences publishes original papers, reviews and short communications on, but not limited to: • Biology, Ecology and Ecosystems, Environmental and Biodiversity • Conservation • Microbiology • Physiology • Genetics and Epidemiology Saudi Journal of Biological Sciences is the official publication of the Saudi Society for Biological Sciences and is published by King Saud University in collaboration with Elsevier and is edited by an international group of eminent researchers.
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