Target-specified Libraries of drug-like compounds with in silico predicted protein affinity were created by applying different computational methods used in Bioinformatics and Structure-Based Drug Design. The Libraries were created with Receptor-based approach to obtain sets of new promising molecules. Keeping pace with modern trends in Drug Discovery and Medicinal Chemistry, Life Chemicals has focused on protein targets as those of highest demand.
Available are the following Targeted Libraries:
Kinase Targeted Docking Library
Kinase Targeted Docking Library (15,000 compounds): CDK2, GSK3, PKB, SRC (2 structures), EGFR. Virtual docking and subsequent general pharmacophore filtering
Sharp-aimed Kinase Targeted Libraries: Advanced docking screening methods and subsequent detailed analysis of each protein-ligand complex structure
Phosphodiesterase 10 (PDE10) Targeted Library
Deubiquitinase Targeted & Focused Libraries
Aquaporins Targeted Libraries
Transmembrane Receptors Targeted Libraries
Nuclear Receptors Targeted Library
PPI Inhibitors (Receptor-based)
Epigenetics Targeted Library