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Computational insights into the binding of IN17 inhibitors to MELK

The protein kinase MELK is an important kinase in cell signaling and has shown to be a promising anti-cancer target. Recent work has resulted in a novel small molecule scaffold targeting MELK, IN17. However, there has been little structural information or physical understanding of MELK-IN17 interact...

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Detalhes bibliográficos
Publicado no:J Mol Model
Main Authors: Harger, Matthew, Lee, Ju-Hyeon, Walker, Brandon, Taliaferro, Juliana M., Edupuganti, Ramakrishna, Dalby, Kevin N., Ren, Pengyu
Formato: Artigo
Idioma:Inglês
Publicado em: 2019
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Acesso em linha:https://ncbi.nlm.nih.gov/pmc/articles/PMC7105934/
https://ncbi.nlm.nih.gov/pubmed/31069524
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1007/s00894-019-4036-1
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