Explore curated transformation-product datasets and their connected chemical relationships.
A collection of metabolism and biotransformation reactions extracted from ChEMBL records. The dataset links parent compounds to reported metabolites and may include associated pharmacological, protein, enzyme, gene, assay, and publication evidence where available.
A collection of metabolite and biotransformation reactions associated with the BioTransformer system. The dataset includes predicted and curated transformations related to human metabolism, microbial metabolism, gut-microbial metabolism, environmental biotransformation, and the formation of metabolites from pharmaceutical and environmental compounds.
