API reference

• core
  • Drug
  • list_pubchem_text_headings()
• data_sources
  • pubchem_properties()
  • pubchem_pug_view_record()
  • pubchem_text_snippets()
  • list_pubchem_text_headings()
  • chembl_molecules_by_inchikey()
  • chembl_mechanisms()
  • chembl_target_detail()
  • chembl_bioactivities()
  • rxnav_interactions()
• id_mapping
  • chembl_to_pubchem_cid()
  • pubchem_cid_from_inchikey()
  • pubchem_cid_to_chembl()
  • pubchem_cid_to_inchikey()
  • unichem_sources()
  • unichem_src_id()
• utils
  • get_json()
  • dedupe_preserve_order()
• features.embeddings
• chemistry
  • RDKitNotAvailable
  • SELFIESNotAvailable
  • mol_from_smiles()
  • to_selfies()
  • molecular_fingerprint()
  • fingerprint_similarity()
  • rdkit_properties()
  • lipinski_violations()
  • synthetic_accessibility()
  • require_rdkit()
• cache
  • APICache
  • get_default_cache()