In Silico Exploration of 1,7-Diazacarbazole Analogs as Checkpoint Kinase 1 Inhibitors by Using 3D QSAR, Molecular Docking Study, and Molecular Dynamics Simulations

Checkpoint kinase 1 (Chk1) is an important serine/threonine kinase with a self-protection function. The combination of Chk1 inhibitors and anti-cancer drugs can enhance the selectivity of tumor therapy. In this work, a set of 1,7-diazacarbazole analogs were identified as potent Chk1 inhibitors throu...

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Detalles Bibliográficos
Autores principales: Gao, Xiaodong, Han, Liping, Ren, Yujie
Formato: Online Artículo Texto
Lenguaje:English
Publicado: MDPI 2016
Materias:
Article
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6273173/
https://www.ncbi.nlm.nih.gov/pubmed/27164065
http://dx.doi.org/10.3390/molecules21050591

Internet

https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6273173/
https://www.ncbi.nlm.nih.gov/pubmed/27164065
http://dx.doi.org/10.3390/molecules21050591

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