chembl_compound_moa |
Function that accepts a ChEMBL molecule identifer and uses the ChEMBL web service API to return its mechanism of action (including disease efficacy, trial phase etc) |
chembl_compound_properties |
Function that accepts a ChEMBL molecule identifer and uses the ChEMBL web service API to return a range of compound properties |
chembl_compound_salts |
Function that accepts a ChEMBL molecule identifer and uses the ChEMBL web service API to return relationships between molecule parents and salts (https://www.ebi.ac.uk/chembl/ws) |
chembl_compound_target_predictions |
Function that accepts a ChEMBL molecule identifer and uses the ChEMBL web service API to return targets for which there is a predictied binding of a the molecular target (https://www.ebi.ac.uk/chembl/ws) |
get_drug |
Function that returns various properties of antineoplastic drugs (targeted and non-targeted) |
get_onco_drugs |
Function that returns various properties of antineoplastic drugs (targeted and non-targeted) |
get_similar_compounds |
Function that accepts a SMILEs and queries PubChem for structurally similar compounds |
pubchem_compound_properties |
Function that retrieves PubChem compound properties using PubChem public user gateway (PUG) |
readUrl |
Function that retrieves PubChem compound properties using PubChem public user gateway (PUG) |