DrugBank Database

소개

The DrugBank Database skill provides programmatic access to a massive repository of bioinformatics and cheminformatics data, covering nearly 10,000 drug entries and 200 data fields. It empowers researchers and developers to extract chemical properties, evaluate drug-drug interactions, and map biological pathways for pharmaceutical applications. Whether you're conducting polypharmacy safety analysis, performing structure-based similarity searches, or identifying potential drug repurposing opportunities, this skill offers the implementation patterns and technical guidance needed to integrate DrugBank data into sophisticated scientific workflows.

주요 기능

• Chemical similarity searching and ADMET property prediction
• Programmatic access to drug properties, SMILES structures, and pharmacology data
• Efficient XML parsing and automated database version management
• Advanced drug-drug interaction (DDI) analysis and safety risk scoring
• 16 GitHub stars
• Target and pathway mapping for mechanism of action studies

사용 사례

• Mapping drugs to biological pathways and metabolic enzymes for pharmacology studies
• Assessing polypharmacy risks and drug interaction networks for clinical safety
• Conducting drug discovery research through structure-based similarity and target identification