Scaffold hopping and optimization towards libraries of glycogen synthase kinase-3 inhibitors
L Nærum, L Nørskov-Lauritsen, PH Olesen - Bioorganic & medicinal …, 2002 - Elsevier
L Nærum, L Nørskov-Lauritsen, PH Olesen
Bioorganic & medicinal chemistry letters, 2002•ElsevierUsing a virtual screening strategy based on a methodology derived from the CATS
molecular descriptor, a novel compound class with inhibitory activity against the GSK-3
enzyme was identified through scaffold hopping. These compounds were readily
synthesized, either by solid-phase or solution-phase chemistry. Compounds with inhibitory
activity below 1 μM were identified.
molecular descriptor, a novel compound class with inhibitory activity against the GSK-3
enzyme was identified through scaffold hopping. These compounds were readily
synthesized, either by solid-phase or solution-phase chemistry. Compounds with inhibitory
activity below 1 μM were identified.
Using a virtual screening strategy based on a methodology derived from the CATS molecular descriptor, a novel compound class with inhibitory activity against the GSK-3 enzyme was identified through scaffold hopping. These compounds were readily synthesized, either by solid-phase or solution-phase chemistry. Compounds with inhibitory activity below 1 μM were identified.
Elsevier