DARTpaths, an in silico platform to investigate molecular mechanisms of compounds

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Abstract

Xpaths is a collection of algorithms that allow for the prediction of compound-induced molecular mechanisms of action by integrating phenotypic endpoints of different species; and proposes follow-up tests for model organisms to validate these pathway predictions. The Xpaths algorithms are applied to predict developmental and reproductive toxicity (DART) and implemented into an in silico platform, called DARTpaths.

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Bhalla, D., Steijaert, M. N., Poppelaars, E. S., Teunis, M., van der Voet, M., Corradi, M., … Wildwater, M. (2023). DARTpaths, an in silico platform to investigate molecular mechanisms of compounds. Bioinformatics, 39(1). https://doi.org/10.1093/bioinformatics/btac767

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