Drug discovery FAQs: workflows for answering multidomain drug discovery questions.
Drug Discov Today
; 20(4): 399-405, 2015 Apr.
Article
em En
| MEDLINE
| ID: mdl-25463038
ABSTRACT
Modern data-driven drug discovery requires integrated resources to support decision-making and enable new discoveries. The Open PHACTS Discovery Platform (http//dev.openphacts.org) was built to address this requirement by focusing on drug discovery questions that are of high priority to the pharmaceutical industry. Although complex, most of these frequently asked questions (FAQs) revolve around the combination of data concerning compounds, targets, pathways and diseases. Computational drug discovery using workflow tools and the integrated resources of Open PHACTS can deliver answers to most of these questions. Here, we report on a selection of workflows used for solving these use cases and discuss some of the research challenges. The workflows are accessible online from myExperiment (http//www.myexperiment.org) and are available for reuse by the scientific community.
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Base de dados:
MEDLINE
Assunto principal:
Preparações Farmacêuticas
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Técnicas de Apoio para a Decisão
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Biologia Computacional
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Descoberta de Drogas
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Fluxo de Trabalho
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Bases de Dados de Compostos Químicos
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Bases de Dados de Produtos Farmacêuticos
Idioma:
En
Ano de publicação:
2015
Tipo de documento:
Article