Generates breakthrough ideas for lead optimization based on bioisosteric structure DB.
- Transformer gives you compound modification ideas from given structures, by using bioisosteric transformation rule-bases such as EMIL and BIOSTER as well as your own rules (e.g. MMP). You can rationally get feasible candidates by filtering based on the properties, structure frameworks, specified substructures etc.
It helps you to generate new compounds that you may have overlooked or simply not thought of, expand your research, develop new strategies.