Targeted Kinase Libraries

Xi, H., Lunney, E. A. (2010) The design, annotation and application of a kinase-targeted-library, in (Zhou, J. Z. ed.) Chemical Library Design. Humana Press, New York, Chapter 14. 

The Design, Annotation, and Application of a Kinase-Targeted Library... 

Key words Protein kinase, kinase-targeted library, library design, kinase chemical cores, substructure search, SMARTS Query, subsetting, binding mode annotation. 

Lowrie, J. F., Delisle, R. K., Hobbs, D. W., Diller, D. J. (2004) The different strategies for designing GPCR and kinase targeted libraries. Comb Chem High Throughput Screen 7, 495-510. 

Chapter 14 in Section IV describes a workflow for designing a kinase targeted library. It illustrates how to assemble a lead generation library for a target family using known ligand-target family interaction data from various sources. 

Akritopoulou-Zanze I, Hajduk PJ (2009) Kinase-targeted libraries the design and synthesis of novel, potent, and selective kinase inhibitors. Drug Discov Today 14 291-297... 

A similar virtual fragment linking approach validated across a variety of different target classes has also been reported [88]. A combination of virtual and experimental (NMR, biochemical) screening methods was employed to identify novel scaffolds for the design of kinase-targeted libraries [89]. 

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