Can this skill analyze drug-drug interactions?

Yes, it can extract interaction networks, classify interactions by severity, and calculate risk scores for polypharmacy regimens.

Does it support chemical informatics like molecular similarity?

Yes, when combined with RDKit, the skill can calculate Tanimoto similarity, generate molecular fingerprints, and perform substructure searches.

Do I need a DrugBank account to use this?

Yes, you must create an account at go.drugbank.com to obtain the credentials required for the drugbank-downloader package to access the database files.

What data can I access with this skill?

You can access detailed information on approximately 9,591 drug entries, including FDA-approved small molecules, biotech drugs, and experimental compounds, along with 200+ data fields per entry.

DrugBank Database Integration

Name: DrugBank Database Integration
Author: Zehong-Wang

byZehong-Wang

0•

数据科学与机器学习

Accesses and analyzes comprehensive pharmaceutical data from DrugBank for drug discovery, pharmacology, and interaction research.

The DrugBank Database skill provides Claude with programmatic access to over 9,500 drug entries, enabling deep analysis of chemical structures, drug-drug interactions, and biological targets. It streamlines workflows for researchers and developers in the pharmaceutical space by providing tools for SMILES/InChI property calculations, pathway mapping, and ADMET predictions. Whether you are conducting polypharmacy safety audits or identifying shared targets for drug repurposing, this skill automates the complex XML parsing and data retrieval processes required to leverage the DrugBank bioinformatics repository efficiently.

主要功能

010 GitHub stars

02Programmatic access and authentication for DrugBank's comprehensive XML database

03Detailed drug property retrieval including SMILES, InChI, and pharmacology data

04Advanced drug-drug interaction (DDI) analysis and clinical risk scoring

05Protein target identification, enzyme mapping, and biological pathway analysis

06Chemical similarity searching and ADMET property prediction using RDKit integration

使用场景

01Clinical decision support for polypharmacy safety and interaction analysis

02Mechanism of action studies and target identification for drug repurposing

03Drug discovery research and lead compound optimization through similarity searches

What are Skills?·How to Install

Install with 🐟 Skill.Fish

npx skillfish add zehong-wang/kosmos drugbank-database

For use in Claude.ai and ChatGPT

主要功能

010 GitHub stars

02Programmatic access and authentication for DrugBank's comprehensive XML database

03Detailed drug property retrieval including SMILES, InChI, and pharmacology data

04Advanced drug-drug interaction (DDI) analysis and clinical risk scoring

05Protein target identification, enzyme mapping, and biological pathway analysis

06Chemical similarity searching and ADMET property prediction using RDKit integration

使用场景

01Clinical decision support for polypharmacy safety and interaction analysis

02Mechanism of action studies and target identification for drug repurposing

03Drug discovery research and lead compound optimization through similarity searches