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DrugComb: an integrative cancer drug combination data portal

机译:DrugComb:综合癌症药物组合数据门户

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摘要

Drug combination therapy has the potential to enhance efficacy, reduce dose-dependent toxicity and prevent the emergence of drug resistance. However, discovery of synergistic and effective drug combinations has been a laborious and often serendipitous process. In recent years, identification of combination therapies has been accelerated due to the advances in high-throughput drug screening, but informatics approaches for systems-level data management and analysis are needed. To contribute toward this goal, we created an open-access data portal called DrugComb () where the results of drug combination screening studies are accumulated, standardized and harmonized. Through the data portal, we provided a web server to analyze and visualize users’ own drug combination screening data. The users can also effectively participate a crowdsourcing data curation effect by depositing their data at DrugComb. To initiate the data repository, we collected 437 932 drug combinations tested on a variety of cancer cell lines. We showed that linear regression approaches, when considering chemical fingerprints as predictors, have the potential to achieve high accuracy of predicting the sensitivity of drug combinations. All the data and informatics tools are freely available in DrugComb to enable a more efficient utilization of data resources for future drug combination discovery.
机译:药物联合疗法具有增强疗效,降低剂量依赖性毒性和预防耐药性的潜力。然而,发现协同有效的药物组合是一个费力且常常偶然的过程。近年来,由于高通量药物筛选的进展,联合疗法的鉴定已得到加速,但是需要用于系统级数据管理和分析的信息学方法。为了实现这一目标,我们创建了一个名为DrugComb()的开放访问数据门户,在该门户中,对药物组合筛选研究的结果进行了累积,标准化和统一。通过数据门户,我们提供了一个网络服务器来分析和可视化用户自己的药物组合筛选数据。用户还可以通过将他们的数据存储在DrugComb上来有效地参与众包数据策划活动。为了启动数据库,我们收集了在多种癌细胞系上测试的437 932种药物组合。我们表明,当将化学指纹作为预测指标时,线性回归方法具有实现预测药物组合敏感性的高精度的潜力。所有数据和信息学工具均可在DrugComb中免费获得,以实现对数据资源的更有效利用,以用于将来的药物组合发现。

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