This is a declaration of intent that ChemSpider will shortly start hosting so-called “Focused Libraries” on ChemSpider in the very near future. The focused libraries will contain a set of compounds with in silico predicted affinities for specific protein targets. The availability of focused libraries can dramatically reduce how many compounds might require experimental examination for activity. The first sets of Focused Libraries have been supplied to us by Otava Chemicals.
This is part of our path to offering new services via ChemSpider. Discussions are underway to integrate to online docking, to the possibility of offering synthetic feasibility analysis and to expand the growing list of services integrated to ChemSpider due to the kindness and support of our collaborators.