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Discovery of N-Aryl-Benzimidazolone Analogs as Novel Potential HSP90 Inhibitors: A Computational Approach

This study aims to identify <i>N-aryl-benzimidazolone</i> analogs as potential inhibitors of the HSP90 protein, which is involved in various diseases. For this, we used computational techniques such as pharmacophoric modeling, virtual screening, in silico ADMET prediction, and molecular dynamics sim...

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Principais autores: Radhia Mazri, Lotfi Bourougaa, Afaf Zekri, Mebarka Ouassaf, Bader Y. Alhatlani
פורמט: Artigo
שפה:Inglês
יצא לאור: MDPI AG 2024-11-01
סדרה:Applied Sciences
נושאים:
HSP90
pharmacophore
virtual screening
ADMET prediction
molecular dynamics simulations
גישה מקוונת:https://www.mdpi.com/2076-3417/14/23/10817
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