Shrouq E Alrashidi, Wejdan F Alanazi, Obaid Afzal, Mubarak A Alamri
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Overlapping core targets were collected by uploading genes into the Bioinformatics and Evolutionary Genomics database. STRING database was used to screen the PPI (protein-protein interaction) network of cross-targets. Cytoscape was used to select core targets and to set up the pathway-gene network. GO (Gene Ontology) enrichment and KEGG (Kyoto Encyclopedia of Genes and Genomes) pathway investigations were executed by the database ShinyGO. A molecular docking examination was performed to explain the interaction between protein targets and calcitriol (active form of vitamin D), and binding affinity was confirmed by a 100-ns molecular dynamics simulation study. 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引用次数: 0
摘要
由于多种原因,包括不佳的中波紫外线体验,倒班工人的维生素D缺乏症正在飙升。本研究的目的是确定维生素D缺乏可能加重轮班工人抑郁症状的确切机制。倒班工作还会扰乱昼夜节律,导致抑郁症状。在GEO数据库中检测了抑郁症患者(GSE80655、GSE169459、GSE217811、GSE190518、GSE98793、GSE23848、GSE76826、GSE101521和GSE54572)和轮班工人(GSE122541)与对照组的差异表达基因(DEGs)。从GenCard数据库中收集了与维生素D缺乏相关的基因。通过将基因上传到生物信息学和进化基因组学数据库,收集重叠的核心靶点。使用STRING数据库筛选交叉靶点的PPI (protein-protein interaction)网络。利用Cytoscape筛选核心靶点,建立通路-基因网络。通过ShinyGO数据库进行GO (Gene Ontology)富集和KEGG (Kyoto Encyclopedia of Genes and Genomes)通路研究。通过分子对接研究,解释了蛋白靶点与骨化三醇(维生素D的活性形式)之间的相互作用,并通过100-ns分子动力学模拟研究证实了结合亲和力。我们的发现表明,维生素D的缺乏可能主要通过TNF、IL-6和IL-1β(促炎标志物)的上调激活炎症反应,参与轮班工人的抑郁病理。
Association between vitamin D deficiency and depressive symptoms among shift workers: Insights from network pharmacology and bioinformatics studies.
Vitamin D deficiency is soaring among shift workers due to multiple issues, including poor UVB experience. The objective of this study was to identify precise mechanisms by which vitamin D deficiency might aggravate depressive symptoms among shift workers. Shift work is also associated with disrupting circadian rhythm, leading to depressive symptoms. Differential expressed genes (DEGs) in depression patients (GSE80655, GSE169459, GSE217811, GSE190518, GSE98793, GSE23848, GSE76826, GSE101521, and GSE54572) and in shift workers (GSE122541) with controls were examined in the GEO database. Genes associated with vitamin D deficiency were gathered from the GenCard database. Overlapping core targets were collected by uploading genes into the Bioinformatics and Evolutionary Genomics database. STRING database was used to screen the PPI (protein-protein interaction) network of cross-targets. Cytoscape was used to select core targets and to set up the pathway-gene network. GO (Gene Ontology) enrichment and KEGG (Kyoto Encyclopedia of Genes and Genomes) pathway investigations were executed by the database ShinyGO. A molecular docking examination was performed to explain the interaction between protein targets and calcitriol (active form of vitamin D), and binding affinity was confirmed by a 100-ns molecular dynamics simulation study. Our finding designated that the deficit of vitamin D might be involved in the pathology of depression among shift workers mainly through activation of the inflammatory response via upregulation of TNF, IL-6, and IL-1β (pro-inflammatory markers).
期刊介绍:
Naunyn-Schmiedeberg''s Archives of Pharmacology was founded in 1873 by B. Naunyn, O. Schmiedeberg and E. Klebs as Archiv für experimentelle Pathologie und Pharmakologie, is the offical journal of the German Society of Experimental and Clinical Pharmacology and Toxicology (Deutsche Gesellschaft für experimentelle und klinische Pharmakologie und Toxikologie, DGPT) and the Sphingolipid Club. The journal publishes invited reviews, original articles, short communications and meeting reports and appears monthly. Naunyn-Schmiedeberg''s Archives of Pharmacology welcomes manuscripts for consideration of publication that report new and significant information on drug action and toxicity of chemical compounds. Thus, its scope covers all fields of experimental and clinical pharmacology as well as toxicology and includes studies in the fields of neuropharmacology and cardiovascular pharmacology as well as those describing drug actions at the cellular, biochemical and molecular levels. Moreover, submission of clinical trials with healthy volunteers or patients is encouraged. Short communications provide a means for rapid publication of significant findings of current interest that represent a conceptual advance in the field.