Ligandscout - structure-based pharmacophores
Ligandscout - structure-based pharmacophore models for virtual screening
The 3D pharmacophore above illustrates the chemical features shared between an inhibitorsof Cyclin Dependent Kinase 2 (CDK2), an important anti-cancer target. The pharmacophore model was created and visualized using the program LigandScout. The model can be used to rapidly screen chemical compound databases for novel potential CDK2 binders.