iPHACE：药理学空间中的综合导航。
iPHACE: integrative navigation in pharmacological space.
机构信息
Chemogenomics Laboratory, Research Unit on Biomedical Informatics (GRIB), Institut Municipal d'Investigació Mèdica and Universitat Pompeu Fabra, Doctor Aiguader 88, 08003 Barcelona, Catalonia, Spain.
出版信息
Bioinformatics. 2010 Apr 1;26(7):985-6. doi: 10.1093/bioinformatics/btq061. Epub 2010 Feb 15.
Abstract
SUMMARY
The increasing availability of experimentally determined binding affinities for drugs on multiple protein targets requires the design of specific mining and visualization tools that graphically integrate chemical and biological data in an efficient environment. With this aim, we developed iPHACE, an integrative web-based tool to navigate in the pharmacological space defined by small molecule drugs contained in the IUPHAR-DB, with additional interactions present in PDSP. Extending beyond traditional querying and filtering tools, iPHACE offers a means to extract knowledge from the target profile of drugs as well as from the drug profile of protein targets.
AVAILABILITY
iPHACE is available at http://cgl.imim.es/iphace/ (EU site) and http://agave.health.unm.edu/iphace/ (US mirror).
摘要
摘要
越来越多的实验确定的药物与多个蛋白靶标结合亲和力的数据，需要设计专门的挖掘和可视化工具，以在一个高效的环境中直观地整合化学和生物学数据。为此，我们开发了 iPHACE，这是一个集成的基于网络的工具，用于在 IUPHAR-DB 中包含的小分子药物所定义的药理学空间中进行导航，并在 PDSP 中提供额外的相互作用。超越传统的查询和筛选工具，iPHACE 提供了一种从药物的靶标特性以及蛋白靶标的药物特性中提取知识的方法。
可用性
iPHACE 可在以下网址获得：http://cgl.imim.es/iphace/（欧盟网站）和 http://agave.health.unm.edu/iphace/（美国镜像）。
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