Discovery of potent PTP1B inhibitors via structure-based drug design, synthesis and in vitro bioassay of Norathyriol derivatives.

Xue, Wenjie; Tian, Jinlong; Wang, Xiang Simon; Xia, Jie; Wu, Song

Xue, Wenjie; Tian, Jinlong; Wang, Xiang Simon; Xia, Jie; Wu, Song.

Afiliação

Xue W; State Key Laboratory of Bioactive Substance and Function of Natural Medicines, Department of New Drug Research and Development, Institute of Materia Medica, Chinese Academy of Medical Sciences and Peking Union Medical College, Beijing 100050, China.
Tian J; State Key Laboratory of Bioactive Substance and Function of Natural Medicines, Department of New Drug Research and Development, Institute of Materia Medica, Chinese Academy of Medical Sciences and Peking Union Medical College, Beijing 100050, China.
Wang XS; Department of Pharmaceutical Sciences, College of Pharmacy, Howard University, Washington DC 20059, USA.
Xia J; State Key Laboratory of Bioactive Substance and Function of Natural Medicines, Department of New Drug Research and Development, Institute of Materia Medica, Chinese Academy of Medical Sciences and Peking Union Medical College, Beijing 100050, China. Electronic address: jie.william.xia@hotmail.com.
Wu S; State Key Laboratory of Bioactive Substance and Function of Natural Medicines, Department of New Drug Research and Development, Institute of Materia Medica, Chinese Academy of Medical Sciences and Peking Union Medical College, Beijing 100050, China. Electronic address: ws@imm.ac.cn.

Bioorg Chem ; 86: 224-234, 2019 05.

Article em En | MEDLINE | ID: mdl-30716620

Assuntos

Descoberta de Drogas; Inibidores Enzimáticos/farmacologia; Proteína Tirosina Fosfatase não Receptora Tipo 1/antagonistas & inibidores; Xantenos/farmacologia; Bioensaio; Relação Dose-Resposta a Droga; Inibidores Enzimáticos/síntese química; Inibidores Enzimáticos/química; Humanos; Simulação de Acoplamento Molecular; Estrutura Molecular; Proteína Tirosina Fosfatase não Receptora Tipo 1/metabolismo; Relação Estrutura-Atividade; Xantenos/síntese química; Xantenos/química

Palavras-chave

Molecular docking; Norathyriol; PTP1B inhibitors; Structure-based drug design

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Texto completo: 1 Bases de dados: MEDLINE Assunto principal: Xantenos / Inibidores Enzimáticos / Proteína Tirosina Fosfatase não Receptora Tipo 1 / Descoberta de Drogas Limite: Humans Idioma: En Revista: Bioorg Chem Ano de publicação: 2019 Tipo de documento: Article País de afiliação: China

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