Exploration and Characterization of the Antimalarial Activity of Pyrimidine-2,4-Diamines for which Resistance is Mediated by the ABCI3 Transporter
Journal Title
ChemMedChem
Publication Type
Dec 12
Abstract
The spread of drug-resistant Plasmodium strains is diminishing the effectiveness of current antimalarials, highlighting the importance of discovering new therapeutics with novel targets. A screen of the Jumpstarter library against P. falciparum identified W482 with a pyrimidine-2,4-diamine scaffold. Structure-activity relationships reveal the importance of the pyrimidine core and its endocyclic nitrogen, while alternative amines are tolerated in the 4-position. Bulky and hydrophobic carboxamides or substituted phenyl ureas display the most potent antiplasmodial activity. Resistance selection and whole genome sequencing reveal an amplification of the gene encoding the ABCI3 transporter protein W482-resistant parasites. W482 is found to exhibit greater activity against parasites with reduced expression of ABCI3, confirming that resistance is related to the transporter. W482 arrests asexual parasites at the ring to trophozoite transition stage and exhibits a fast-killing profile with a lag phase of 24 h. Improving the antiparasitic activity alongside metabolic stability and solubility remains a challenge in the future development of the pyrimidine-2,4-diamine class.
Publisher
Wiley
Keywords
Plasmodium; ABCI3 transporter; antimalarial; malaria; pyrimidine‐2,4‐diamine
Research Division(s)
New Medicines and Diagnostics; Bioinformatics and Computational Biology; Infection and Global Health
PubMed ID
41387370
Open Access at Publisher's Site
https://doi.org/10.1002/cmdc.202500739
Terms of Use/Rights Notice
Refer to copyright notice on published article.


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