MetaDrug (GeneGo Inc.) is a unique systems pharmacology suite designed for the analysis of biological effects of small molecule compounds. MetaDrug combines the power of systems biology (target CVs, OMICs data analysis), flexibility of classical chemical tools (QSAR, metabolic rules) and reliability of a comprehensive manually curated "knowledge base" for predicting therapeutic and toxic effects for new molecules. Upload your structure or OMICs data to evaluate potential targets, affected pathways, indications, and off-target effects. You can apply MetaDrug for hit-to-lead optimization, drug repositioning, compound ranking, competitive intelligence (compare your drug to competitor's). No need to synthesize or assay hundreds of compounds! Upload a whole library to triage it by hit pathways, possible indications, potential ADME and toxicity issues.
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