DrugBank Database

概要

Empower your scientific research with programmatic access to the extensive DrugBank bioinformatics database. This skill facilitates deep dives into over 9,000 drug entries, allowing users to extract chemical properties, navigate complex drug-drug interaction networks, and map pharmaceutical targets to biological pathways. Whether you are conducting drug discovery, performing safety analyses for polypharmacy, or exploring structure-activity relationships, this tool provides the technical guidance needed to parse XML data, perform chemical similarity searches, and integrate pharmaceutical insights into automated Python-based workflows.

主な機能

• Target identification and biological pathway mapping
• 2,066 GitHub stars
• Drug-Drug Interaction (DDI) analysis and clinical risk scoring
• Molecular similarity searches and ADMET property predictions
• Comprehensive drug information retrieval and chemical structure extraction
• Automated database downloading and efficient XML parsing guidance

ユースケース

• Analyzing polypharmacy regimens for potential safety risks and contraindications
• Conducting drug discovery research and identifying candidate molecules for repurposing
• Building bioinformatics pipelines to study drug-protein interactions and metabolism pathways