Data-Driven Analysis of Fluorination of Ligands of Aminergic G Protein Coupled Receptors.

Pietrus, Wojciech; Kurczab, Rafal; Stumpfe, Dagmar; Bojarski, Andrzej J; Bajorath, Jürgen

Pietrus, Wojciech; Kurczab, Rafal; Stumpfe, Dagmar; Bojarski, Andrzej J; Bajorath, Jürgen.

Afiliação

Pietrus W; Department of Medicinal Chemistry, Maj Institute of Pharmacology, Polish Academy of Sciences, Smetna 12, 31-343 Krakow, Poland.
Kurczab R; Department of Life Science Informatics, LIMES Program Unit Chemical Biology and Medicinal Chemistry, B-IT, Rheinische Friedrich-Wilhelms-Universität, Friedrich-Hirzebruch-Allee 6, D-53115 Bonn, Germany.
Stumpfe D; Department of Medicinal Chemistry, Maj Institute of Pharmacology, Polish Academy of Sciences, Smetna 12, 31-343 Krakow, Poland.
Bojarski AJ; Department of Life Science Informatics, LIMES Program Unit Chemical Biology and Medicinal Chemistry, B-IT, Rheinische Friedrich-Wilhelms-Universität, Friedrich-Hirzebruch-Allee 6, D-53115 Bonn, Germany.
Bajorath J; Department of Medicinal Chemistry, Maj Institute of Pharmacology, Polish Academy of Sciences, Smetna 12, 31-343 Krakow, Poland.

Biomolecules ; 11(11)2021 11 08.

Article em En | MEDLINE | ID: mdl-34827645

Assuntos

Receptores Acoplados a Proteínas G; Halogenação; Ligação Proteica

Palavras-chave

ChEMBL; G protein-coupled receptors; GPCR; MMP; activity cliffs; aminergic receptors; fluorine

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Texto completo: 1 Base de dados: MEDLINE Assunto principal: Receptores Acoplados a Proteínas G Idioma: En Revista: Biomolecules Ano de publicação: 2021 Tipo de documento: Article País de afiliação: Polônia

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