Our main chemoinformatic tools are:
→ the OECD QSAR Toolbox, which specifically supports data gap filling through Read-Across and Category formation;
→ Toxtree, which includes collections of mechanistically-based SAs for genotoxicity;
→ Leadscope Model Applier, a chemoinformatic platform including both expert alerts and statistical models for genotoxicity (in specific compliance with ICH M7 Guidance on pharmaceutical impurities).
Alpha-PreTox has vast experience in applying these models, as well as notable expertise in interpreting genotoxicity predictions. Our expertise derives from both our participation in the development of the OECD QSAR Toolbox and Toxtree, and our focus, over the course of many years, on the mechanistic aspects of the chemical structure/genotoxicity relationships.
Alpha-PreTox also excels in the analysis of large data sets relative to toxicological results, and in the construction of Ontologies.