Contrastive learning in protein language space predicts interactions between drugs and protein targets.

Singh, Rohit; Sledzieski, Samuel; Bryson, Bryan; Cowen, Lenore; Berger, Bonnie

Singh, Rohit; Sledzieski, Samuel; Bryson, Bryan; Cowen, Lenore; Berger, Bonnie.

Afiliação

Singh R; Computer Science and Artificial Intelligence Laboratory, Massachusetts Institute of Technology, Cambridge, MA 02139.
Sledzieski S; Computer Science and Artificial Intelligence Laboratory, Massachusetts Institute of Technology, Cambridge, MA 02139.
Bryson B; Ragon Institute of MGH, MIT and Harvard, Cambridge, MA 02139.
Cowen L; Department of Biological Engineering, Massachusetts Institute of Technology, Cambridge, MA 02139.
Berger B; Department of Computer Science, Tufts University, Medford, MA 02155.

Proc Natl Acad Sci U S A ; 120(24): e2220778120, 2023 Jun 13.

Article em En | MEDLINE | ID: mdl-37289807

Assuntos

Descoberta de Drogas; Proteínas; Humanos; Proteínas/química; Descoberta de Drogas/métodos; Avaliação Pré-Clínica de Medicamentos; Idioma

Palavras-chave

contrastive learning; drug discovery; drugtarget interaction; protein language models

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Texto completo: 1 Base de dados: MEDLINE Assunto principal: Proteínas / Descoberta de Drogas Tipo de estudo: Prognostic_studies / Risk_factors_studies Limite: Humans Idioma: En Ano de publicação: 2023 Tipo de documento: Article

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