tool_lists/chembl_tools.json

[
    {
        "type": "ChEMBLTool",
        "name": "ChEMBL_search_similar_molecules",
        "description": "Search for molecules similar to a given SMILES, chembl_id, or compound or drug name, using the ChEMBL Web Services.",
        "parameter": {
            "type": "object",
            "properties": {
                "query": { "type": "string", "description": "SMILES string, chembl_id, or compound or drug name." },
                "similarity_threshold": { "type": "integer", "description": "Similarity threshold (0–100).", "default": 80 },
                "max_results": { "type": "integer", "description": "Maximum number of results to return.", "default": 20 }
            },
            "required": ["query"]
        }
    }
]