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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Autores principales:	Radhia Mazri, Lotfi Bourougaa, Afaf Zekri, Mebarka Ouassaf, Bader Y. Alhatlani
Formato:	Artigo
Lenguaje:	Inglês
Publicado:	MDPI AG 2024-11-01
Colección:	Applied Sciences
Materias:	HSP90 pharmacophore virtual screening ADMET prediction molecular dynamics simulations
Acceso en línea:	https://www.mdpi.com/2076-3417/14/23/10817
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