Computational Approaches for Identification of Potential Plant Bioactives as Novel G6PD Inhibitors Using Advanced Tools and Databases.

Aldossari, Rana M; Ali, Aarif; Rehman, Muneeb U; Rashid, Summya; Ahmad, Sheikh Bilal

Aldossari, Rana M; Ali, Aarif; Rehman, Muneeb U; Rashid, Summya; Ahmad, Sheikh Bilal.

Afiliação

Aldossari RM; Department of Pharmacology & Toxicology, College of Pharmacy, Prince Sattam Bin Abdulaziz University, P.O. Box 173, Al-Kharj 11942, Saudi Arabia.
Ali A; Division of Veterinary Biochemistry, Faculty of Veterinary Science and Animal Husbandry, SKUAST-Kashmir, Alustang, Shuhama 190006, Jammu & Kashmir, India.
Rehman MU; Department of Clinical Pharmacy, College of Pharmacy, King Saud University, P.O. Box 2457, Riyadh 11451, Saudi Arabia.
Rashid S; Department of Pharmacology & Toxicology, College of Pharmacy, Prince Sattam Bin Abdulaziz University, P.O. Box 173, Al-Kharj 11942, Saudi Arabia.
Ahmad SB; Division of Veterinary Biochemistry, Faculty of Veterinary Science and Animal Husbandry, SKUAST-Kashmir, Alustang, Shuhama 190006, Jammu & Kashmir, India.

Molecules ; 28(7)2023 Mar 28.

Article em En | MEDLINE | ID: mdl-37049781

Assuntos

Glucosefosfato Desidrogenase; Neoplasias; Humanos; Estaurosporina/farmacologia; Simulação de Dinâmica Molecular; Via de Pentose Fosfato

Palavras-chave

ADMET; CASTp; G6PD; bioactives; docking; dynamics; homology; toxicity

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Texto completo: 1 Coleções: 01-internacional Base de dados: MEDLINE Assunto principal: Glucosefosfato Desidrogenase / Neoplasias Tipo de estudo: Diagnostic_studies / Prognostic_studies Limite: Humans Idioma: En Ano de publicação: 2023 Tipo de documento: Article

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