In Silico biological evaluation of propolis for modulating Ghrelin, Leptin and CYP17A1 gene pathways in Polycystic Ovary Syndrome
Year: 2025
Type: article
Abstract: The study focused on identifying the potential phytochemicals from the propolis, a beehive byproduct, as a modulator in Ghrelin, Leptin and CYP17A1 gene pathways. From ADMET and molecular docking analysis, Quercetin and Chrysin show good binding interactions with target receptors and obey drug-like properties compared to the standard drug Lorcaserin. The Molecular dynamics simulation of protein-ligand complexes revealed Quercetin-binding proteins are slightly lower RMSD indicating a stable association of Quercetin with the Ghrelin receptor.
Source: ENTOMON
Authors: Ashmitha Elangovan, N. Aarthi, P.B. Harathi
Language: English
Subfield: Computational Theory and Mathematics
Field: Computer Science
Domain: Physical Sciences
Open Access status: diamond
OpenAlex ID: W4412526461