OntoChem recently took part in the virtuell conference AI-SDV Conference “in Nice” on October 5th to 6th 2020.
We provided insight into an interesting molecular property prediction system which we developed for e.g. drug candidates by taking advantage of our key technologies, the OntoChem chemical ontology and sophisticated text mining algorithms, complemented by machine learning algorithms.
Applying this to a compound property of high interest, toxicity, it is also applicable to other properties like antimicrobial. Further refinement of this exciting approach can now start, taking into account OntoChem’s triple store.
Feel free to contact us if you have any questions. You can also have a look at the presentation we gave here. ToxScore@AI-SDV (PDF, 6MB)