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Many Approved Drugs Have Bioactive Analogs With Different Target Annotations

Close structural relationships between approved drugs and bioactive compounds were systematically assessed using matched molecular pairs. For structural analogs of drugs, target information was assembled from ChEMBL and compared to drug targets reported in DrugBank. For many drugs, multiple analogs...

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Autors principals: Hu, Ye, Lounkine, Eugen, Bajorath, Jürgen
Format: Artigo
Idioma:Inglês
Publicat: Springer US 2014
Matèries:
Accés en línia:https://ncbi.nlm.nih.gov/pmc/articles/PMC4070249/
https://ncbi.nlm.nih.gov/pubmed/24871342
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1208/s12248-014-9621-8
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