Department of Software Engineering and Bioinformatics, Johannes Gutenberg University of Mainz, 55128 Mainz, Institute for Computer Science, Johann Wolfgang Goethe-University Frankfurt am Main, 60054 Frankfurt am Main, Data Science, Pharma Research and Early Development Informatics (pREDi), Roche Diagnostics GmbH, 82377 Penzberg, Department of Human Genetics, Saarland University Faculty of Medicine, 66421 Homburg and Lead Identification and Optimization Support, Boehringer-Ingelheim Pharma GmbH & Co. KG, 88397 Biberach, Germany.