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QSAR, Molecular Docking and protein ligand interaction fingerprint studies of N-phenyl dichloroacetamide derivatives as anticancer agents

Dichloroacetate (DCA) is a pyruvate mimetic compound that stimulates the activity of the enzyme pyruvate dehydrogenase (PDH) through inhibition of the enzyme pyruvate dehydrogenase kinases (PDK1-4). DCA works by turning on the apoptosis which is suppressed in tumor cells, hence let them to die on th...

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Principais autores: Masood Fereidoonnezhad, Zeinab Faghih, Elham Jokar, Ayyub Mojaddami, Zahra Rezaei, Mehdi Khoshneviszadeh
Formato: Artigo
Idioma:Inglês
Publicado em: Shiraz University of Medical Sciences 2016-06-01
coleção:Trends in Pharmaceutical Sciences
Assuntos:
in silico screening
molecular docking
n-phenyl dichloroacetamide
protein ligand interaction fingerprints
qsar
Acesso em linha:https://tips.sums.ac.ir/article_42195_072396b245b96fd805158616da82a912.pdf
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