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DrugCentral 2021 supports drug discovery and repositioning

DrugCentral is a public resource (http://drugcentral.org) that serves the scientific community by providing up-to-date drug information, as described in previous papers. The current release includes 109 newly approved (October 2018 through March 2020) active pharmaceutical ingredients in the US, Eur...

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Autores principales: Avram, Sorin, Bologa, Cristian G, Holmes, Jayme, Bocci, Giovanni, Wilson, Thomas B, Nguyen, Dac-Trung, Curpan, Ramona, Halip, Liliana, Bora, Alina, Yang, Jeremy J, Knockel, Jeffrey, Sirimulla, Suman, Ursu, Oleg, Oprea, Tudor I
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Oxford University Press 2020
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC7779058/
https://www.ncbi.nlm.nih.gov/pubmed/33151287
http://dx.doi.org/10.1093/nar/gkaa997
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author Avram, Sorin
Bologa, Cristian G
Holmes, Jayme
Bocci, Giovanni
Wilson, Thomas B
Nguyen, Dac-Trung
Curpan, Ramona
Halip, Liliana
Bora, Alina
Yang, Jeremy J
Knockel, Jeffrey
Sirimulla, Suman
Ursu, Oleg
Oprea, Tudor I
author_facet Avram, Sorin
Bologa, Cristian G
Holmes, Jayme
Bocci, Giovanni
Wilson, Thomas B
Nguyen, Dac-Trung
Curpan, Ramona
Halip, Liliana
Bora, Alina
Yang, Jeremy J
Knockel, Jeffrey
Sirimulla, Suman
Ursu, Oleg
Oprea, Tudor I
author_sort Avram, Sorin
collection PubMed
description DrugCentral is a public resource (http://drugcentral.org) that serves the scientific community by providing up-to-date drug information, as described in previous papers. The current release includes 109 newly approved (October 2018 through March 2020) active pharmaceutical ingredients in the US, Europe, Japan and other countries; and two molecular entities (e.g. mefuparib) of interest for COVID19. New additions include a set of pharmacokinetic properties for ∼1000 drugs, and a sex-based separation of side effects, processed from FAERS (FDA Adverse Event Reporting System); as well as a drug repositioning prioritization scheme based on the market availability and intellectual property rights forFDA approved drugs. In the context of the COVID19 pandemic, we also incorporated REDIAL-2020, a machine learning platform that estimates anti-SARS-CoV-2 activities, as well as the ‘drugs in news’ feature offers a brief enumeration of the most interesting drugs at the present moment. The full database dump and data files are available for download from the DrugCentral web portal.
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spelling pubmed-77790582021-01-07 DrugCentral 2021 supports drug discovery and repositioning Avram, Sorin Bologa, Cristian G Holmes, Jayme Bocci, Giovanni Wilson, Thomas B Nguyen, Dac-Trung Curpan, Ramona Halip, Liliana Bora, Alina Yang, Jeremy J Knockel, Jeffrey Sirimulla, Suman Ursu, Oleg Oprea, Tudor I Nucleic Acids Res Database Issue DrugCentral is a public resource (http://drugcentral.org) that serves the scientific community by providing up-to-date drug information, as described in previous papers. The current release includes 109 newly approved (October 2018 through March 2020) active pharmaceutical ingredients in the US, Europe, Japan and other countries; and two molecular entities (e.g. mefuparib) of interest for COVID19. New additions include a set of pharmacokinetic properties for ∼1000 drugs, and a sex-based separation of side effects, processed from FAERS (FDA Adverse Event Reporting System); as well as a drug repositioning prioritization scheme based on the market availability and intellectual property rights forFDA approved drugs. In the context of the COVID19 pandemic, we also incorporated REDIAL-2020, a machine learning platform that estimates anti-SARS-CoV-2 activities, as well as the ‘drugs in news’ feature offers a brief enumeration of the most interesting drugs at the present moment. The full database dump and data files are available for download from the DrugCentral web portal. Oxford University Press 2020-11-05 /pmc/articles/PMC7779058/ /pubmed/33151287 http://dx.doi.org/10.1093/nar/gkaa997 Text en © The Author(s) 2020. Published by Oxford University Press on behalf of Nucleic Acids Research. http://creativecommons.org/licenses/by/4.0/ This is an Open Access article distributed under the terms of the Creative Commons Attribution License (http://creativecommons.org/licenses/by/4.0/), which permits unrestricted reuse, distribution, and reproduction in any medium, provided the original work is properly cited.
spellingShingle Database Issue
Avram, Sorin
Bologa, Cristian G
Holmes, Jayme
Bocci, Giovanni
Wilson, Thomas B
Nguyen, Dac-Trung
Curpan, Ramona
Halip, Liliana
Bora, Alina
Yang, Jeremy J
Knockel, Jeffrey
Sirimulla, Suman
Ursu, Oleg
Oprea, Tudor I
DrugCentral 2021 supports drug discovery and repositioning
title DrugCentral 2021 supports drug discovery and repositioning
title_full DrugCentral 2021 supports drug discovery and repositioning
title_fullStr DrugCentral 2021 supports drug discovery and repositioning
title_full_unstemmed DrugCentral 2021 supports drug discovery and repositioning
title_short DrugCentral 2021 supports drug discovery and repositioning
title_sort drugcentral 2021 supports drug discovery and repositioning
topic Database Issue
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC7779058/
https://www.ncbi.nlm.nih.gov/pubmed/33151287
http://dx.doi.org/10.1093/nar/gkaa997
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