Toward Metabolic Similarity in Read-Across: A Case Study Using Graph Convolutional Networks to Predict Genotoxicity Outcomes from Simulated Metabolic Networks.
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DOI: 10.1021/acs.chemrestox.5c00120
Abstract: Metabolic similarity is a key consideration in evaluating candidate source analogues for read-across (RAx), but approaches to systematically characterize metabolism for read-across prediction are still evolving. Metabolic similarity is multifaceted, considering the similarity of the… read more here.
Keywords: genotoxicity outcomes; metabolic similarity; metabolism; read across ... See more keywords