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In Silico HTS and Structure Based Optimization of Indazole-Derived ULK1 Inhibitors

[Image: see text] We present the outcome of an in silico high throughput screen (HTS) and optimization of a small molecule Unc-51-Like Kinase 1 (ULK1) inhibitor hit, SR-17398, with an indazole core. Docking studies guided design efforts that led to inhibitors with increased activity vs ULK1 (IC(50)...

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Pubblicato in:ACS Med Chem Lett
Autori principali: Wood, Spencer D., Grant, Wayne, Adrados, Isabel, Choi, Jun Yong, Alburger, James M., Duckett, Derek R., Roush, William R.
Natura: Artigo
Lingua:Inglês
Pubblicazione: American Chemical Society 2017
Accesso online:https://ncbi.nlm.nih.gov/pmc/articles/PMC5733266/
https://ncbi.nlm.nih.gov/pubmed/29259744
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1021/acsmedchemlett.7b00344
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