chembl-database - Query ChEMBL database for molecules, targets, and activities
Query the ChEMBL database for bioactive molecules, drug targets, bioactivity data, approved drugs, and chemical structures.
Tags
Updated: 2026-09-24Capabilities
Typical Inputs
Typical Outputs
What this skill does
- Query ChEMBL API endpoints
- Search bioactive molecules
- Fetch drug target details
- Filter bioactivity data
- Perform structure searches
- Download structure images
Inputs
- ChEMBL IDs
- Molecule names
- Target names
- SMILES strings
- Bioactivity filter parameters
- UniProt accessions
Outputs
- JSON result files
- SDF structure files
- SVG structure images
- PNG structure images
- License notification file
Requirements
- uv
- scripts/chembl_api.py