Journal of Medicinal Chemistry · 2013 · 150 citations · 53 references
PharmacyMedicinal ChemistryPharmacologyDrug DesignDrug DiscoveryMolecular VirologyAntiviral AgentsAntiviral PharmacologyEnzyme InhibitionPeptide ChemistryPeptide Drug DiscoveryProteolytic EnzymesAntiviral Drug DesignAntiviral PeptidesAntiviral Structure-activity RelationshipsHydrophobic InteractionsPeptide Medicinal ChemistryPeptide Structure - Activity RelationshipsPeptide Structure-activity RelationshipsProtease Inhibitors
The protease of dengue virus is a promising target for antiviral drug discovery. We here report a new generation of peptide-hybrid inhibitors of dengue protease that incorporate N-substituted 5-arylidenethiazolidinone heterocycles (rhodanines and thiazolidinediones) as N-terminal capping groups of the peptide moiety. The compounds were extensively characterized with respect to inhibition of various proteases, inhibition mechanisms, membrane permeability, antiviral activity, and cytotoxicity in cell culture. A sulfur/oxygen exchange in position 2 of the capping heterocycle (thiazolidinedione-capped vs rhodanine-capped peptide hybrids) has a significant effect on these properties and activities. The most promising in vitro affinities were observed for thiazolidinedione-based peptide hybrids containing hydrophobic groups with Ki values between 1.5 and 1.8 μM and competitive inhibition mechanisms. Rhodanine-capped peptide hybrids with hydrophobic substituents have, in correlation with their membrane permeability, a more pronounced antiviral activity in cell culture than the thiazolidinediones.
53
The global distribution and burden of dengue
Samir Bhatt, Peter W. Gething, Oliver J. Brady et al. · Nature · 2013 · 10.2K citations · Full text
Public Health, Infectious Disease Control, Infectious Diseases +12
The determination of enzyme inhibitor constants
Martin Dixon · Biochemical Journal · 1953 · 4.1K citations · Full text