Journal of Medicinal Chemistry · 2012 · 64 citations · 28 references
MedicinePharmacokineticsPharmacologyBioavailabilityDrug DiscoveryNeuropharmacologyBlood-brain Barrier PharmacologyDrug DispositionEnzyme InhibitionNeurochemical PharmacologyNeurodegenerative Disease PharmacologyNeuroprotectionAmyloid InhibitionBeta Secretase InhibitionInhibition Of Amyloid FormationNeurologic PharmacologyOral Bioavailability OptimizationOral Drug BioavailabilityPharmacokinetics In Neurodegenerative DiseaseTherapeutic Targeting Of Amyloid
A series of potent hydroxyethyl amine (HEA) derived inhibitors of β-site APP cleaving enzyme (BACE1) was optimized to address suboptimal pharmacokinetics and poor CNS partitioning. This work identified a series of benzodioxolane analogues that possessed improved metabolic stability and increased oral bioavailability. Subsequent efforts focused on improving CNS exposure by limiting susceptibility to Pgp-mediated efflux and identified an inhibitor which demonstrated robust and sustained reduction of CNS β-amyloid (Aβ) in Sprague-Dawley rats following oral administration.
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<i>Phaser</i>crystallographic software
Airlie J. McCoy, Ralf W. Grosse‐Kunstleve, Paul D. Adams et al. · Journal of Applied Crystallography · 2007 · 20.9K citations · Full text