Kinase Inhibitor Scaffold Hopping with Deep Learning Approaches.

Hu, Lizhao; Yang, Yuyao; Zheng, Shuangjia; Xu, Jun; Ran, Ting; Chen, Hongming

Hu, Lizhao; Yang, Yuyao; Zheng, Shuangjia; Xu, Jun; Ran, Ting; Chen, Hongming.

Afiliación

Hu L; School of Biotechnology and Health Sciences, Wuyi University, Jiangmen 529020, China.
Yang Y; Research Center for Drug Discovery, School of Pharmaceutical Sciences, Sun Yat-Sen University, 132 East Circle at University City, Guangzhou 510006, China.
Zheng S; Center of Cell Lineage and Atlas, Bioland Laboratory (Guangzhou Regenerative Medicine and Health-Guangdong Laboratory), Guangzhou 510530, China.
Xu J; Research Center for Drug Discovery, School of Pharmaceutical Sciences, Sun Yat-Sen University, 132 East Circle at University City, Guangzhou 510006, China.
Ran T; School of Data and Computer Science, Sun Yat-sen University, Guangzhou 510006, China.
Chen H; School of Biotechnology and Health Sciences, Wuyi University, Jiangmen 529020, China.

J Chem Inf Model ; 61(10): 4900-4912, 2021 10 25.

Article en En | MEDLINE | ID: mdl-34586824

Asunto(s)

Aprendizaje Profundo; Diseño de Fármacos; Unión Proteica; Inhibidores de Proteínas Quinasas/farmacología; Proteínas Quinasas

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Texto completo: 1 Bases de datos: MEDLINE Asunto principal: Aprendizaje Profundo Idioma: En Revista: J Chem Inf Model Asunto de la revista: INFORMATICA MEDICA / QUIMICA Año: 2021 Tipo del documento: Article País de afiliación: China

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