Identification of New Potential Cyclooxygenase-2 Inhibitors Using Structure-Based Virtual Screening, Molecular Dynamics and Pharmacokinetic Modelling-Reference-Cited by-同舟云学术

Identification of New Potential Cyclooxygenase-2 Inhibitors Using Structure-Based Virtual Screening, Molecular Dynamics and Pharmacokinetic Modelling

Published:2024-09-06 Issue: Volume:11 Page:6
ISSN:
Container-title:IECBM 2024
language:
Short-container-title:

Author:

Derardja Imene¹,Rebai Redouane¹²^ORCID,Toumi Mohamed Esseddik³^ORCID,Kebaili Farouk Fethi³⁴⁵⁶^ORCID,Boudah Abdennacer²

Affiliation:

1. Laboratory Promotion of Innovation in Agriculture in Arid Regions (PIARA), Faculty of Nature and Life Sciences, University of Mohamed Khider, Biskra 07000, Algeria

2. Laboratory of Biotechnology, National Higher School of Biotechnology, Constantine 25000, Algeria

3. Laboratory of Microbiological Engineering and Application, Department of Biochemistry and Molecular and Cellular Biology, University of Mentouri Brothers, Constantine 25017, Algeria

4. The Regional Laboratory of Scientific Police, Ain El Bey Road-Constantine, Constantine 25017, Algeria

5. The Sub-Directorate of Scientific and Technical Police, Algiers 16000, Algeria

6. The General Directorate of National Security, Algiers 16000, Algeria

Publisher

MDPI

Link

https://www.mdpi.com/2673-9976/35/1/6/pdf

Reference33 articles.

1. Cyclooxygenase 2: Understanding the pathophysiological role through genetically altered mouse models;Hortelano;Front. Biosci.,2006

2. In silico approach to design new cyclooxygenase-2 (COX-2) inhibitors based on MM/QM and ADMET analysis;Kharwar;Chem. Phys. Impact,2024

3. Selective COX-2 inhibitors: A review of their structure-activity relationships;Zarghi;Iran. J. Pharm. Res.,2011

4. Prostanoids in health and disease;Smyth;J. Lipid Res.,2009

5. Al-Ghulikah, H.A., El-Sebaey, S.A., Bass, A.K., and El-Zoghbi, M.S. (2022). New pyrimidine-5-carbonitriles as COX-2 inhibitors: Design, synthesis, anticancer screening, molecular docking, and in silico ADME profile studies. Molecules, 21.