Chembl Tools

Configuration File: chembl_tools.json Tool Type: Local Tools Count: 1

This page contains all tools defined in the chembl_tools.json configuration file.

Available Tools

ChEMBL_search_similar_molecules (Type: ChEMBLTool)

Search for molecules similar to a given SMILES, chembl_id, or compound or drug name, using the Ch…

ChEMBL_search_similar_molecules tool specification

Tool Information:

  • Name: ChEMBL_search_similar_molecules

  • Type: ChEMBLTool

  • Description: Search for molecules similar to a given SMILES, chembl_id, or compound or drug name, using the ChEMBL Web Services.

Parameters:

  • query (string) (required) SMILES string, chembl_id, or compound or drug name.

  • similarity_threshold (integer) (optional) Similarity threshold (0–100).

  • max_results (integer) (optional) Maximum number of results to return.

Example Usage:

query = {
    "name": "ChEMBL_search_similar_molecules",
    "arguments": {
        "query": "example_value"
    }
}
result = tu.run(query)