Identification of Type-II Inhibitors Using Kinase Structures (pages 657–664)
Frank Lovering, Joseph McDonald, Gavin A. Whitlock, Paul A. Glossop, Chris Phillips, Andrew Bent, Yogesh Sabnis, Mark Ryan, Lori Fitz, Julie Lee, Jeanne S. Chang, Seungil Han, Ravi Kurumbail and Atli Thorarensen
Version of Record online: 3 SEP 2012 | DOI: 10.1111/j.1747-0285.2012.01443.x
A protein structure/ligand based approach has been successfully utilized to identify ligands that bind to novel conformations of Spleen Tyrosine Kinase (Syk). Kinase protein crystal structure databases have been applied to the discovery of the first Syk type-II ligands, including a DFG-out inhibitor and a rare deep pocket c-helix out inhibitor.