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Synthesis and biological evaluation of pyridine-based derivatives as potential inhibitors of Leishmania major propagation

Year: 2026
Type: article
Abstract: = 393.04 µM; selectivity index = 46.63). To gain further insight, molecular docking and 100 ns molecular dynamics (MD) simulations were carried out to explore the possible binding interactions and dynamic stability of 5e within the PTR1 active site. These computational analyses support the compound's proposed inhibitory capacity against Lm-PTR1. Collectively, our results introduce a promising new class of antileishmanial agents that act through selective disruption of the folate biosynthesis pathway, highlighting their considerable therapeutic promise in the fight against leishmaniasis.
Source: RSC Advances
DOI: 10.1039/d6ra07150c
Authors: Ahmed Sabt, Adnan A. Bekhit, Hanaa Farag, Huda Jawad, Kikuko Amagase, Hoda Atef Abdelsattar Ibrahim, Tamer M. Ibrahim, Abdelsamed I. Elshamy, Moataz A. Shaldam, Wagdy M. Eldehna
Institutions: National Research Centre, University of Bahrain, Alexandria University, Ritsumeikan University, Cairo University, Kafrelsheikh University, Al Salam University
Language: English
Field: Medicine
Open Access status: gold
Estimated APC paid: $1,042
OpenAlex ID: W7223682677
FWCI:
Cites: 66
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Related to: 10