After the redocking of generated compounds, the final binding mode assessment & filtering, our Chemical Space Docking delivers a set of molecules that are likely to bind to the target of interest. Since chemical rules have been applied to create the Chemical Space (e.g. robust chemical reactions
or in-house knowledge), hit candidates have a high likelihood of synthetic accessibility.
Several pharmaceutical companies already utilize the concept of combinatorial reaction chemistry to create their own, proprietary Chemical Spaces
. Renown chemical compound makers have inhaled the power and possibilities behind this approach and responded with their own Chemical Spaces
: Users can search for commercially available, "make-on-demand" compounds. The application of robust in-house chemical reactions is reflected in a high synthetic success rate and delivery rates of few weeks.