In-silico Study of Molecular Docking and Dynamics Simulations for N-Substituted Thiazolidinones Derived from (R)-Carvone Targeting PPAR-γ Protein: Synthesis and Characterization DOI
Yassine Riadi,

Ammar A. Razzak Mahmood,

Mohammed H. Geesi

et al.

Polycyclic aromatic compounds, Journal Year: 2024, Volume and Issue: unknown, P. 1 - 26

Published: Oct. 22, 2024

Language: Английский

Evaluation of Vitis vinifera seed oil as a green corrosion inhibitor for high-carbon steel and ferrovanadium alloys in sulfuric acid DOI Creative Commons
Roland Tolulope Loto,

Ordinakachukwu Uvemena Uyanwune,

Ayomide Oreoluwa Oluwasesan

et al.

International Journal of Electrochemical Science, Journal Year: 2025, Volume and Issue: unknown, P. 100936 - 100936

Published: Jan. 1, 2025

Language: Английский

Citations

0
Insights into a tetra dentate schiff base complex: Structural, electronic and antifungal target interactions DOI

T. Murugan,

Rangaswamy Venkatesh,

Predhanekar Mohamed Imran

et al.

Journal of Molecular Liquids, Journal Year: 2025, Volume and Issue: unknown, P. 126987 - 126987

Published: Jan. 1, 2025

Language: Английский

Citations

0
Therapeutic Potential of Nitrogen‐Substituted Oleanolic Acid Derivatives in Neuroinflammatory and Cytokine Pathways: Insights From Cell‐Based and Computational Models DOI
Gurbet Çelik Turgut,

Nicole Pepe,

Yağmur Ceylan Ekiz

et al.

Chemistry & Biodiversity, Journal Year: 2025, Volume and Issue: unknown

Published: April 22, 2025

ABSTRACT This study was conducted to investigate the mechanism of potential and anti‐inflammatory properties nitrogen‐substituted oleanolic acid derivatives that can be used treat neuroinflammatory diseases. Nitrogen‐containing have been evaluated for their anti‐neuroinflammatory effects in vitro neuronal monocytic cell lines at nontoxic doses, production cytokines (TNF‐α, IL‐6 IL‐17), inflammatory enzyme induced nitric oxide synthase (iNOS) NF‐κB signalling under LPS‐stimulated conditions, expression genes associated with Alzheimer's disease assessed. In addition, molecular docking dynamics simulation assessments are silico. Key protein markers neurodegenerative diseases, especially neuroinflammation, TAU levels, microglial activation, as well ionised calcium‐binding adaptor protein‐1 (IBA1) were significantly reduced addition derivatives. LPS‐induced luciferase reporter activity iNOS inhibited, approaching levels uninduced controls. The mRNA proinflammatory critical such TNF‐α, NF‐κB, IL‐17, twofold sevenfold. Furthermore, MD analyses revealed interactions TNF‐α proteins. These findings underscore derivatives, particularly compound 16 , candidates further development therapeutic agents diseases chronic inflammation.

Language: Английский

Citations

0
In-silico Study of Molecular Docking and Dynamics Simulations for N-Substituted Thiazolidinones Derived from (R)-Carvone Targeting PPAR-γ Protein: Synthesis and Characterization DOI
Yassine Riadi,

Ammar A. Razzak Mahmood,

Mohammed H. Geesi

et al.

Polycyclic aromatic compounds, Journal Year: 2024, Volume and Issue: unknown, P. 1 - 26

Published: Oct. 22, 2024

Language: Английский

Citations

0