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      A standard database for drug repositioning

      data-paper
      1 , a , 1
      Scientific Data
      Nature Publishing Group
      Drug development, Pharmaceutics

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          Abstract

          Drug repositioning, the process of discovering, validating, and marketing previously approved drugs for new indications, is of growing interest to academia and industry due to reduced time and costs associated with repositioned drugs. Computational methods for repositioning are appealing because they putatively nominate the most promising candidate drugs for a given indication. Comparing the wide array of computational repositioning methods, however, is a challenge due to inconsistencies in method validation in the field. Furthermore, a common simplifying assumption, that all novel predictions are false, is intellectually unsatisfying and hinders reproducibility. We address this assumption by providing a gold standard database, repoDB, that consists of both true positives (approved drugs), and true negatives (failed drugs). We have made the full database and all code used to prepare it publicly available, and have developed a web application that allows users to browse subsets of the data ( http://apps.chiragjpgroup.org/repoDB/).

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          Author and article information

          Journal
          Sci Data
          Sci Data
          Scientific Data
          Nature Publishing Group
          2052-4463
          14 March 2017
          2017
          : 4
          : 170029
          Affiliations
          [1 ]Department of Biomedical Informatics, Harvard Medical School , 10 Shattuck St, Boston, Massachusetts 02115, USA
          Author notes
          [a ] C.J.P. (email: Chirag_Patel@ 123456hms.harvard.edu ).
          []

          A.S.B. and C.J.P. conceived of the study. A.S.B. conducted all statistical analyses. A.S.B. and C.J.P. wrote the manuscript.

          Author information
          http://orcid.org/0000-0002-4393-1003
          http://orcid.org/0000-0002-8756-8525
          Article
          sdata201729
          10.1038/sdata.2017.29
          5349249
          28291243
          1d873e09-1fe2-4673-8179-e962847754a3
          Copyright © 2017, The Author(s)

          This work is licensed under a Creative Commons Attribution 4.0 International License. The images or other third party material in this article are included in the article’s Creative Commons license, unless indicated otherwise in the credit line; if the material is not included under the Creative Commons license, users will need to obtain permission from the license holder to reproduce the material. To view a copy of this license, visit http://creativecommons.org/licenses/by/4.0 Metadata associated with this Data Descriptor is available at http://www.nature.com/sdata/ and is released under the CC0 waiver to maximize reuse.

          History
          : 23 September 2016
          : 20 January 2017
          Categories
          Data Descriptor

          drug development,pharmaceutics
          drug development, pharmaceutics

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