| Literature DB >> 34342443 |
Edmund Oboh1, Tanner J Schubert1, Jose E Teixeira2, Erin E Stebbins2, Peter Miller2, Emily Philo1, Haresh Thakellapalli1, Scott D Campbell3, David W Griggs3,4, Christopher D Huston2, Marvin J Meyers1,4.
Abstract
Cryptosporidiosis is caused by infection of the small intestine by Cryptosporidium parasites, resulting in severe diarrhea, dehydration, malabsorption, and potentially death. The only FDA-approved therapeutic is only partially effective in young children and ineffective for immunocompromised patients. Triazolopyridazine MMV665917 is a previously reported anti-Cryptosporidium screening hit with in vivo efficacy but suffers from modest inhibition of the hERG ion channel, which could portend cardiotoxicity. Herein, we describe our initial development of structure-activity relationships of this novel lead series with a particular focus on optimization of the piperazine-urea linker. We have discovered that piperazine-acetamide is a superior linker resulting in identification of SLU-2633, which has an EC50 of 0.17 μM, an improved projected margin versus hERG, prolonged pharmacokinetic exposure in small intestine, and oral efficacy in vivo with minimal systemic exposure. SLU-2633 represents a significant advancement toward the identification of a new effective and safe treatment for cryptosporidiosis.Entities:
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Year: 2021 PMID: 34342443 PMCID: PMC8792998 DOI: 10.1021/acs.jmedchem.1c01136
Source DB: PubMed Journal: J Med Chem ISSN: 0022-2623 Impact factor: 8.039