Development of a 3D visualization and 3D similarity search for improved identification of drugs with adverse drug reactions (ADRs) and ist application for nuclear receptors

• Unité de recherche: INNOSUISSE
• Numéro de projet: 6570.2;8 MTS-LS
• Titre du projet anglais: Development of a 3D visualization and 3D similarity search for improved identification of drugs with adverse drug reactions (ADRs) and ist application for nuclear receptors

Description succincte (Allemand)

Development of a 3D visualization and 3D similarity search for improved identification of drugs with adverse drug reactions (ADRs) and its application for nuclear receptors

Description succincte (Anglais)

Development of a 3D visualization and 3D similarity search for improved identification of drugs with adverse drug reactions (ADRs) and ist application for nuclear receptors

Résumé des résultats (Abstract) (Anglais)

SafeBaseTM (TheraSTrat) is a theragenomic knowledge management system, which integrates data from medical sciences, biology and chemistry. The general aim is the prediction of adverse drug reactions (ADRs). An add-in for more precise predictions of the chemical structure of new drugs in regard to possible ADRs shall be developed. Most cheminformatics software systems allow searching for whole molecules or fragments in 2D.