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Fig. 2 | Journal of Cheminformatics

Fig. 2

From: Leveraging heterogeneous data from GHS toxicity annotations, molecular and protein target descriptors and Tox21 assay readouts to predict and rationalise acute toxicity

Fig. 2

Agreement heatmap between GHS acute toxicity categorisations of common compounds in the GHS data sources. For the purpose of this analysis, implied nontoxic compounds were treated as belonging to a hypothetical category 6. The heatmap indicates that common compounds’ acute toxicity classifications tend to exhibit higher agreement when comparing classifications for the same route of exposure; however, agreement between different routes of exposure are generally substantially lower

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