Drug difficult binding pockets using ligand macrocyclization
Macrocyclization of pharmaceutical compounds presents several advantages such as diverse functionality, favorable drug-like properties; and increased selectivity. Macrocycle formation using Spark can be a beneficial technique for drug discovery scientists, in helping to find targets for ‘difficult to drug’ binding pockets.
Once the experiment is completed, results can be displayed using different views:
Additionally, results can be annotated and tagged to facilitate collaboration across teams. Promising candidates can be labeled as favorites, filtered, and exported directly into Flare™, for in-depth analysis with a variety of methods.
Results from the Spark macrocyclization experiment, displayed using the 'Tile' results view.