1 Department of Bioengineering, Marmara University, Istanbul , Turkey .
2 Department of Bioengineering, Istanbul Medeniyet University , Istanbul, Turkey .
OMICS. 2017 Oct;21(10):584-591. doi: 10.1089/omi.2017.0127.
Drug repositioning is an innovative approach to identify new therapeutic indications for existing drugs. Drug repositioning offers the promise of reducing drug development timeframes and costs, and because it involves drugs that are already in the clinic, it might remedy some of the drug safety challenges traditionally associated with drug candidates that are not yet available in the clinic. The gene-by-drug interactions are an important dimension of optimal drug repositioning and development strategies. While gene-by-drug interactions have been curated and presented in various databases, novel bioinformatics tools and approaches are timely, and required with a specific focus to support drug positioning. We report, in this study, the design of a public web-accessible transcriptomic-/gene expression-guided pharmaceuticals search tool, geneXpharma ( www.genexpharma.org ). GeneXpharma is a public platform with user-centric interface that provides statistically evaluated gene expressions and their drug interactions for 48 diseases under seven different disease categories. GeneXpharma is designed and organized to generate hypotheses on druggable genome within the disease-gene-drug triad and thus, help repositioning of drugs against diseases. The search system accommodates various entry points using drugs, genes, or diseases, which then enable researchers to extract drug repurposing candidates and readily export for further evaluation. Future developments aim to improve the geneXpharma algorithm, enrich its content, and enhance the website interface through addition of network visualizations and graphical display items. Bioinformatics search tools can help enable the convergence of drug repositioning and gene-by-drug interactions so as to further optimize drug development efforts in the future.
药物重定位是一种识别现有药物新治疗用途的创新方法。药物重定位有望缩短药物开发时间和降低成本,而且由于它涉及已经在临床使用的药物,因此可能解决与尚未在临床使用的候选药物相关的一些药物安全性挑战。基因-药物相互作用是药物重新定位和开发策略的一个重要方面。虽然基因-药物相互作用已在各种数据库中进行了整理和呈现,但新型生物信息学工具和方法是及时的,并且需要特别关注以支持药物定位。在这项研究中,我们报告了设计一个公共可访问的转录组/基因表达指导药物搜索工具,即 geneXpharma(www.genexpharma.org)。geneXpharma 是一个具有用户为中心界面的公共平台,为七种不同疾病类别下的 48 种疾病提供经过统计学评估的基因表达及其药物相互作用。geneXpharma 的设计和组织旨在生成疾病-基因-药物三联体中的可药物基因组假设,从而帮助重新定位针对疾病的药物。搜索系统通过药物、基因或疾病提供各种入口点,从而使研究人员能够提取药物重新定位候选药物,并可轻松导出以进行进一步评估。未来的发展目标是改进 geneXpharma 算法、丰富其内容,并通过添加网络可视化和图形显示项来增强网站界面。生物信息学搜索工具可以帮助实现药物重定位和基因-药物相互作用的融合,从而进一步优化未来的药物开发工作。