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Chemical enrichment analysis software tools | Drug discovery

Ontology-based enrichment analysis aids in the interpretation and understanding of large-scale biological data. Ontologies are hierarchies of biologically relevant groupings. Using ontology annotations, which link ontology classes to biological…
MSEA
Web

MSEA Metabolite Set Enrichment Analysis

A web-based tool to help identify and interpret patterns of metabolite…

A web-based tool to help identify and interpret patterns of metabolite concentration changes in a biologically meaningful context for human and mammalian metabolomic studies. Key to the development…

MPEA
Web

MPEA Metabolite Pathway Enrichment Analysis

A rapid tool for functional analysis and biological interpretation of metabolic…

A rapid tool for functional analysis and biological interpretation of metabolic profiling data. MPEA follows the concept of gene set enrichment analysis (GSEA) and tests whether metabolites involved…

CART
Desktop
Web

CART Chemical annotation retrieval toolkit

A chemical annotation retrieval toolkit. As a key functionality, CART matches…

A chemical annotation retrieval toolkit. As a key functionality, CART matches an input list of chemical names into a comprehensive reference space to assign unambiguous chemical identifiers. In this…

BiNChE
Web

BiNChE

An enrichment analysis tool for small molecules based on the ChEBI Ontology.…

An enrichment analysis tool for small molecules based on the ChEBI Ontology. BiNChE displays an interactive graph that can be exported as a high-resolution image or in network formats. The tool…

MBRole
Web

MBRole Metabolite Biological Role

Performs overrepresentation (enrichment) analysis of categorical annotations…

Performs overrepresentation (enrichment) analysis of categorical annotations for a set of compounds of interest. These categorical annotations correspond to biological and chemical information…

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