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Journal of Medicinal Chemistry|September 6, 2014
Exploring the scaffold universe of kinase inhibitorsYe Hu, Jürgen BajorathJournal of Chemical Information and Modeling|January 24, 2013
Systematic identification of scaffolds representing compounds active against individual targets and single or multiple target familiesYe Hu, Jürgen BajorathEuropean Journal of Medicinal Chemistry|March 8, 2014
Many drugs contain unique scaffolds with varying structural relationships to scaffolds of currently available bioactive compoundsYe Hu, Jürgen BajorathMolecular Informatics|August 31, 2016
Hierarchical Analysis of Bioactive Matched Molecular Pairs, Encoded Chemical Transformations, and Associated SubstructuresYe Hu, Jürgen BajorathJournal of Chemical Information and Modeling|April 6, 2010
Molecular scaffolds with high propensity to form multi-target activity cliffsYe Hu, Jürgen BajorathJournal of Chemical Information and Modeling|November 19, 2011
Target family-directed exploration of scaffolds with different SAR profilesYe Hu, Jürgen BajorathDrug Discovery Today|March 26, 2013
Compound promiscuity: what can we learn from current data?Ye Hu, Jürgen BajorathThe AAPS Journal|October 24, 2012
How promiscuous are pharmaceutically relevant compounds? A data-driven assessmentYe Hu, Jürgen BajorathJournal of Chemical Information and Modeling|January 29, 2011
Combining horizontal and vertical substructure relationships in scaffold hierarchies for activity predictionYe Hu, Jürgen BajorathPageof 87