Fragment hopping protocol for the design of small-molecule protein-protein interaction inhibitors.

Kell, Shelby R; Wang, Zhen; Ji, Haitao

Kell, Shelby R; Wang, Zhen; Ji, Haitao.

Afiliación

Kell SR; Drug Discovery Department, H. Lee Moffitt Cancer Center & Research Institute, Tampa, FL 33612, United States; Department of Chemistry, University of South Florida, Tampa, FL 33620, United States.
Wang Z; Drug Discovery Department, H. Lee Moffitt Cancer Center & Research Institute, Tampa, FL 33612, United States; Department of Chemistry, University of South Florida, Tampa, FL 33620, United States.
Ji H; Drug Discovery Department, H. Lee Moffitt Cancer Center & Research Institute, Tampa, FL 33612, United States; Department of Chemistry, University of South Florida, Tampa, FL 33620, United States. Electronic address: Haitao.Ji@Moffitt.org.

Bioorg Med Chem ; 69: 116879, 2022 09 01.

Article en En | MEDLINE | ID: mdl-35749838

Asunto(s)

Bibliotecas de Moléculas Pequeñas; Programas Informáticos; Diseño de Fármacos; Ligandos; Unión Proteica; Bibliotecas de Moléculas Pequeñas/química

Palabras clave

Computational fragment-based ligand discovery; Fragment hopping; Pharmacophores; Proteinprotein interactions; Small-molecule inhibitors; de novo design

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Texto completo: 1 Colección: 01-internacional Base de datos: MEDLINE Asunto principal: Programas Informáticos / Bibliotecas de Moléculas Pequeñas Idioma: En Revista: Bioorg Med Chem Asunto de la revista: BIOQUIMICA / QUIMICA Año: 2022 Tipo del documento: Article País de afiliación: Estados Unidos Pais de publicación: Reino Unido

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