485285 clusters Max cluster size: 21 Cluster Size Distribution 1 319224 2 157910 3 6632 4 783 5 277 6 123 7 92 8 142 9 51 10 27 11 18 12 2 13 1 14 1 17 1 21 1 Cluster Type Distribution frozenset({('DRUGBANK', 1), ('MESH', 1), ('UMLS', 1), ('INCHIKEY', 1)}) 1 frozenset({('CHEBI', 1), ('UNII', 1), ('UMLS', 1), ('KEGG.COMPOUND', 1), ('RXCUI', 1), ('DRUGBANK', 1), ('CHEMBL.COMPOUND', 1), ('INCHIKEY', 1)}) 1 frozenset({('CHEBI', 1), ('DRUGCENTRAL', 1), ('UMLS', 1), ('UNII', 1), ('RXCUI', 1)}) 1 frozenset({('DRUGCENTRAL', 1), ('UNII', 1), ('UMLS', 1), ('RXCUI', 1), ('MESH', 1), ('CAS', 1), ('CHEMBL.COMPOUND', 1)}) 1 frozenset({('DRUGCENTRAL', 1), ('GTOPDB', 1), ('UNII', 1), ('UMLS', 1), ('MESH', 1), ('DRUGBANK', 1), ('CHEMBL.COMPOUND', 1)}) 1 frozenset({('UNII', 1), ('UMLS', 1), ('RXCUI', 1), ('MESH', 1), ('DRUGBANK', 1), ('CHEMBL.COMPOUND', 1), ('INCHIKEY', 1)}) 1 frozenset({('RXCUI', 2), ('DRUGCENTRAL', 1), ('GTOPDB', 1), ('UNII', 1), ('UMLS', 1), ('DRUGBANK', 2), ('CHEMBL.COMPOUND', 2), ('MESH', 1)}) 1 frozenset({('CHEBI', 1), ('GTOPDB', 1), ('UNII', 1), ('UMLS', 1), ('KEGG.COMPOUND', 1), ('RXCUI', 1), ('MESH', 1), ('DRUGBANK', 1), ('CHEMBL.COMPOUND', 1), ('INCHIKEY', 1)}) 1 frozenset({('DRUGCENTRAL', 1), ('GTOPDB', 1), ('INCHIKEY', 1), ('UNII', 1), ('UMLS', 1), ('RXCUI', 1), ('MESH', 1), ('DRUGBANK', 1), ('CHEMBL.COMPOUND', 1), ('HMDB', 1)}) 1 frozenset({('CHEBI', 1), ('DRUGCENTRAL', 1), ('UNII', 1), ('UMLS', 1), ('KEGG.COMPOUND', 1), ('RXCUI', 1), ('MESH', 1), ('DRUGBANK', 1), ('CHEMBL.COMPOUND', 1)}) 1 frozenset({('DRUGCENTRAL', 1), ('UNII', 1), ('UMLS', 1), ('DRUGBANK', 2), ('MESH', 1), ('CHEMBL.COMPOUND', 1)}) 1 frozenset({('RXCUI', 1), ('UMLS', 1), ('DRUGBANK', 11)}) 1 frozenset({('GTOPDB', 1), ('INCHIKEY', 1), ('UNII', 1), ('MESH', 1), ('DRUGBANK', 1), ('HMDB', 1)}) 1 frozenset({('CHEBI', 1), ('INCHIKEY', 1), ('UNII', 1), ('UMLS', 1), ('MESH', 1), ('DRUGBANK', 1), ('HMDB', 1)}) 1 frozenset({('UMLS', 1), ('MESH', 1), ('CHEBI', 1), ('CAS', 1)}) 1 frozenset({('CHEBI', 1), ('UNII', 1), ('UMLS', 1), ('MESH', 1), ('CAS', 1), ('INCHIKEY', 1)}) 1 frozenset({('CHEBI', 1), ('UMLS', 1), ('RXCUI', 1), ('DRUGBANK', 1), ('INCHIKEY', 1)}) 1 frozenset({('UNII', 1), ('UMLS', 1), ('HMDB', 1), ('DRUGBANK', 1), ('CHEMBL.COMPOUND', 1), ('INCHIKEY', 1)}) 1 frozenset({('UNII', 1), ('UMLS', 1), ('RXCUI', 1), ('HMDB', 1), ('DRUGBANK', 1), ('CHEMBL.COMPOUND', 1), ('INCHIKEY', 1)}) 1 frozenset({('CHEMBL.COMPOUND', 1), ('UNII', 1), ('DRUGCENTRAL', 1), ('INCHIKEY', 1)}) 1 frozenset({('INCHIKEY', 1), ('UNII', 1), ('UMLS', 1), ('KEGG.COMPOUND', 1), ('DRUGBANK', 1), ('CHEMBL.COMPOUND', 1), ('HMDB', 1)}) 1 frozenset({('UNII', 1), ('RXCUI', 1), ('DRUGBANK', 1), ('CHEMBL.COMPOUND', 1), ('INCHIKEY', 1)}) 1 frozenset({('UNII', 1), ('UMLS', 1), ('MESH', 1), ('CAS', 1), ('DRUGBANK', 1), ('CHEMBL.COMPOUND', 1), ('INCHIKEY', 1)}) 1 frozenset({('DRUGCENTRAL', 1), ('UMLS', 1), ('MESH', 1), ('DRUGBANK', 1), ('CHEMBL.COMPOUND', 1), ('UNII', 2)}) 1 frozenset({('DRUGBANK', 1), ('CHEBI', 1), ('INCHIKEY', 1), ('KEGG.COMPOUND', 1)}) 1 frozenset({('CHEBI', 1), ('UMLS', 1), ('UNII', 1), ('RXCUI', 1), ('MESH', 1), ('DRUGBANK', 1)}) 1 frozenset({('CHEBI', 1), ('INCHIKEY', 1), ('UNII', 1), ('UMLS', 1), ('KEGG.COMPOUND', 1), ('RXCUI', 1), ('MESH', 1), ('CHEMBL.COMPOUND', 1), ('HMDB', 1)}) 1 frozenset({('UMLS', 1), ('MESH', 2), ('RXCUI', 1), ('CAS', 1), ('DRUGBANK', 1)}) 1 frozenset({('MESH', 1), ('CHEBI', 1), ('CAS', 1), ('KEGG.COMPOUND', 1)}) 1 frozenset({('CHEBI', 1), ('UMLS', 1), ('KEGG.COMPOUND', 1), ('RXCUI', 1), ('MESH', 1), ('CHEMBL.COMPOUND', 1), ('INCHIKEY', 1)}) 1 frozenset({('DRUGCENTRAL', 1)}) 1 frozenset({('CHEBI', 1), ('DRUGCENTRAL', 1), ('MESH', 2), ('UNII', 1), ('UMLS', 1), ('KEGG.COMPOUND', 1), ('RXCUI', 1), ('DRUGBANK', 1), ('CHEMBL.COMPOUND', 1)}) 1 frozenset({('DRUGCENTRAL', 1), ('INCHIKEY', 1), ('UNII', 1), ('UMLS', 1), ('KEGG.COMPOUND', 1), ('RXCUI', 1), ('DRUGBANK', 1), ('CHEMBL.COMPOUND', 1), ('HMDB', 1)}) 1 frozenset({('DRUGCENTRAL', 1), ('UNII', 1), ('UMLS', 1), ('RXCUI', 1), ('MESH', 1), ('DRUGBANK', 1)}) 1 frozenset({('UMLS', 1), ('UNII', 1), ('KEGG.COMPOUND', 1), ('MESH', 1), ('INCHIKEY', 1)}) 1 frozenset({('DRUGBANK', 1), ('INCHIKEY', 1), ('HMDB', 1), ('KEGG.COMPOUND', 1)}) 1 frozenset({('GTOPDB', 1), ('UMLS', 1), ('UNII', 1), ('DRUGBANK', 1), ('INCHIKEY', 1)}) 1 frozenset({('GTOPDB', 1), ('INCHIKEY', 1), ('UNII', 1), ('UMLS', 1), ('MESH', 1), ('CAS', 1), ('DRUGBANK', 1), ('CHEMBL.COMPOUND', 1), ('HMDB', 1)}) 1 frozenset({('CHEBI', 1), ('UMLS', 1), ('UNII', 1), ('RXCUI', 1), ('MESH', 1), ('INCHIKEY', 1)}) 1 frozenset({('DRUGBANK', 1), ('UMLS', 1), ('UNII', 1), ('DRUGCENTRAL', 1)}) 1 frozenset({('CHEBI', 1), ('DRUGCENTRAL', 1), ('GTOPDB', 1), ('UNII', 1), ('UMLS', 1), ('KEGG.COMPOUND', 1), ('RXCUI', 1), ('MESH', 1), ('DRUGBANK', 1), ('CHEMBL.COMPOUND', 1)}) 1 frozenset({('DRUGBANK', 7), ('UMLS', 1), ('RXCUI', 1)}) 1 frozenset({('CHEBI', 1), ('UMLS', 1), ('RXCUI', 1), ('MESH', 1), ('INCHIKEY', 1)}) 1 frozenset({('DRUGCENTRAL', 1), ('UMLS', 1), ('UNII', 1), ('RXCUI', 1), ('DRUGBANK', 1), ('INCHIKEY', 1)}) 1 frozenset({('UMLS', 1), ('DRUGBANK', 2), ('MESH', 1), ('UNII', 1)}) 1 frozenset({('RXCUI', 2), ('DRUGCENTRAL', 1), ('UNII', 1), ('MESH', 1), ('DRUGBANK', 1), ('CHEMBL.COMPOUND', 1), ('UMLS', 2), ('INCHIKEY', 1)}) 1 frozenset({('CHEBI', 1), ('UNII', 1), ('KEGG.COMPOUND', 1), ('DRUGBANK', 1), ('CHEMBL.COMPOUND', 1), ('INCHIKEY', 1)}) 1 frozenset({('DRUGCENTRAL', 1), ('CHEBI', 1), ('INCHIKEY', 1), ('UMLS', 1), ('RXCUI', 1), ('CHEMBL.COMPOUND', 2), ('DRUGBANK', 1), ('UNII', 2), ('HMDB', 1)}) 1 frozenset({('CHEBI', 1), ('INCHIKEY', 1), ('PUBCHEM.COMPOUND', 1)}) 1 frozenset({('DRUGBANK', 2), ('MESH', 1), ('UMLS', 1), ('CAS', 1)}) 1 frozenset({('UMLS', 1), ('CHEMBL.COMPOUND', 2), ('UNII', 1), ('DRUGCENTRAL', 1)}) 1 frozenset({('DRUGCENTRAL', 1), ('CHEBI', 1), ('MESH', 2), ('UNII', 1), ('UMLS', 1), ('KEGG.COMPOUND', 1), ('CHEMBL.COMPOUND', 2)}) 1 frozenset({('CHEBI', 1), ('GTOPDB', 1), ('UNII', 1), ('UMLS', 1), ('RXCUI', 1), ('MESH', 1), ('CHEMBL.COMPOUND', 1), ('INCHIKEY', 1)}) 1 frozenset({('DRUGCENTRAL', 1), ('UNII', 1), ('UMLS', 1), ('CHEMBL.COMPOUND', 2), ('MESH', 1), ('DRUGBANK', 1), ('INCHIKEY', 1)}) 1 frozenset({('CHEBI', 1), ('INCHIKEY', 1), ('UNII', 1), ('UMLS', 1), ('KEGG.COMPOUND', 1), ('MESH', 1), ('CAS', 1), ('DRUGBANK', 1), ('CHEMBL.COMPOUND', 1), ('HMDB', 1)}) 1 frozenset({('DRUGCENTRAL', 1), ('UMLS', 1), ('UNII', 1), ('RXCUI', 1), ('DRUGBANK', 1)}) 1 frozenset({('CHEBI', 1), ('DRUGCENTRAL', 1), ('UNII', 1), ('UMLS', 1), ('RXCUI', 1), ('MESH', 1), ('CAS', 1), ('DRUGBANK', 1), ('CHEMBL.COMPOUND', 1)}) 1 frozenset({('DRUGCENTRAL', 1), ('RXCUI', 1), ('CHEMBL.COMPOUND', 2), ('MESH', 1), ('UMLS', 2), ('DRUGBANK', 1), ('UNII', 2)}) 1 frozenset({('GTOPDB', 1), ('INCHIKEY', 1), ('UNII', 1), ('UMLS', 1), ('RXCUI', 1), ('MESH', 1), ('DRUGBANK', 1), ('CHEMBL.COMPOUND', 1), ('HMDB', 1)}) 1 frozenset({('CHEBI', 1), ('UMLS', 1), ('KEGG.COMPOUND', 1), ('MESH', 1), ('DRUGBANK', 1), ('INCHIKEY', 1)}) 1 frozenset({('DRUGCENTRAL', 1), ('GTOPDB', 1), ('MESH', 2), ('UNII', 1), ('UMLS', 1), ('RXCUI', 1), ('DRUGBANK', 1)}) 1 frozenset({('RXCUI', 2), ('CHEBI', 1), ('DRUGCENTRAL', 1), ('DRUGBANK', 2), ('MESH', 1), ('UMLS', 2), ('CAS', 1), ('CHEMBL.COMPOUND', 1), ('UNII', 2), ('INCHIKEY', 1)}) 1 frozenset({('DRUGCENTRAL', 1), ('UMLS', 1), ('RXCUI', 1), ('DRUGBANK', 2), ('CHEMBL.COMPOUND', 2), ('MESH', 1), ('UNII', 2), ('INCHIKEY', 1)}) 1 frozenset({('DRUGBANK', 1), ('UNII', 1), ('DRUGCENTRAL', 1), ('INCHIKEY', 1)}) 1 frozenset({('UMLS', 1), ('MESH', 1), ('DRUGCENTRAL', 1)}) 1 frozenset({('CHEBI', 1), ('INCHIKEY', 1), ('UNII', 1), ('UMLS', 1), ('KEGG.COMPOUND', 1), ('MESH', 1), ('DRUGBANK', 1), ('CHEMBL.COMPOUND', 1), ('HMDB', 1)}) 1 frozenset({('GTOPDB', 1), ('UNII', 1), ('MESH', 1), ('DRUGBANK', 1), ('INCHIKEY', 1)}) 1 frozenset({('DRUGCENTRAL', 1), ('UMLS', 1), ('UNII', 1), ('RXCUI', 1), ('MESH', 1), ('INCHIKEY', 1)}) 1 frozenset({('CHEBI', 1), ('UMLS', 1), ('RXCUI', 1), ('MESH', 1), ('DRUGBANK', 1)}) 1 frozenset({('DRUGCENTRAL', 1), ('UMLS', 1), ('UNII', 1), ('DRUGBANK', 1), ('INCHIKEY', 1)}) 1 frozenset({('DRUGBANK', 1), ('UMLS', 1), ('DRUGCENTRAL', 1), ('RXCUI', 1)}) 1 frozenset({('RXCUI', 2), ('DRUGCENTRAL', 1), ('MESH', 1), ('UNII', 2), ('DRUGBANK', 1), ('UMLS', 2)}) 1 frozenset({('UMLS', 1), ('UNII', 1), ('DRUGCENTRAL', 1)}) 1 frozenset({('CHEBI', 1), ('UNII', 1), ('UMLS', 1), ('MESH', 1), ('DRUGBANK', 1), ('INCHIKEY', 1)}) 1 frozenset({('CHEBI', 1), ('DRUGCENTRAL', 1), ('GTOPDB', 1), ('UNII', 1), ('UMLS', 1), ('KEGG.COMPOUND', 1), ('RXCUI', 1), ('DRUGBANK', 2), ('MESH', 1), ('CHEMBL.COMPOUND', 1)}) 1 frozenset({('DRUGCENTRAL', 1), ('MESH', 2), ('UNII', 1), ('RXCUI', 1), ('UMLS', 3), ('DRUGBANK', 1), ('CHEMBL.COMPOUND', 1)}) 1 frozenset({('CHEBI', 1), ('UMLS', 1), ('KEGG.COMPOUND', 1), ('RXCUI', 1), ('MESH', 1), ('CAS', 1)}) 1 frozenset({('GTOPDB', 1), ('UNII', 1), ('RXCUI', 1), ('DRUGBANK', 1), ('CHEMBL.COMPOUND', 1), ('INCHIKEY', 1)}) 1 frozenset({('CHEBI', 1), ('INCHIKEY', 1), ('UNII', 1), ('KEGG.COMPOUND', 1), ('DRUGBANK', 1), ('HMDB', 1)}) 1 frozenset({('UNII', 1), ('UMLS', 1), ('HMDB', 1), ('MESH', 1), ('DRUGBANK', 1), ('INCHIKEY', 1)}) 1 frozenset({('CHEBI', 1), ('DRUGCENTRAL', 1), ('UNII', 1), ('UMLS', 1), ('MESH', 1), ('INCHIKEY', 1)}) 1 frozenset({('GTOPDB', 1), ('UNII', 1), ('UMLS', 1), ('MESH', 1), ('DRUGBANK', 1), ('CHEMBL.COMPOUND', 1), ('INCHIKEY', 1)}) 1 frozenset({('DRUGCENTRAL', 1), ('UNII', 1), ('UMLS', 1), ('KEGG.COMPOUND', 1), ('RXCUI', 1), ('DRUGBANK', 1), ('CHEMBL.COMPOUND', 1), ('INCHIKEY', 1)}) 1 frozenset({('DRUGCENTRAL', 1), ('GTOPDB', 1), ('UNII', 1), ('UMLS', 1), ('RXCUI', 1), ('MESH', 1), ('CHEMBL.COMPOUND', 1), ('INCHIKEY', 1)}) 1 frozenset({('UNII', 1), ('KEGG.COMPOUND', 1), ('DRUGBANK', 1), ('CHEMBL.COMPOUND', 1), ('INCHIKEY', 1)}) 1 frozenset({('DRUGCENTRAL', 1), ('UMLS', 1), ('KEGG.COMPOUND', 1), ('RXCUI', 1), ('DRUGBANK', 1), ('CHEMBL.COMPOUND', 1), ('INCHIKEY', 1)}) 1 frozenset({('RXCUI', 2), ('CHEBI', 1), ('DRUGCENTRAL', 1), ('GTOPDB', 1), ('KEGG.COMPOUND', 2), ('INCHIKEY', 1), ('CHEMBL.COMPOUND', 2), ('MESH', 1), ('UMLS', 2), ('DRUGBANK', 1), ('UNII', 2), ('HMDB', 1)}) 1 frozenset({('DRUGCENTRAL', 1), ('GTOPDB', 1), ('UNII', 1), ('UMLS', 1), ('RXCUI', 1), ('DRUGBANK', 2), ('MESH', 1), ('CHEMBL.COMPOUND', 1)}) 1 frozenset({('UNII', 1), ('MESH', 1), ('DRUGBANK', 1), ('UMLS', 2), ('INCHIKEY', 1)}) 1 frozenset({('DRUGBANK', 1), ('RXCUI', 1), ('UNII', 1), ('INCHIKEY', 1)}) 1 frozenset({('CHEBI', 1), ('DRUGCENTRAL', 1), ('INCHIKEY', 1), ('MESH', 2), ('UNII', 1), ('UMLS', 1), ('KEGG.COMPOUND', 1), ('DRUGBANK', 1), ('CHEMBL.COMPOUND', 1), ('HMDB', 1)}) 1 frozenset({('RXCUI', 1), ('DRUGBANK', 2), ('UMLS', 1), ('INCHIKEY', 1)}) 1 frozenset({('UNII', 1), ('HMDB', 1), ('DRUGBANK', 1), ('CHEMBL.COMPOUND', 1), ('INCHIKEY', 1)}) 1 frozenset({('RXCUI', 1), ('UMLS', 1), ('DRUGCENTRAL', 1)}) 1 frozenset({('DRUGCENTRAL', 1), ('UNII', 1), ('UMLS', 1), ('RXCUI', 1), ('MESH', 1), ('DRUGBANK', 1), ('CHEMBL.COMPOUND', 1), ('INCHIKEY', 1)}) 1 frozenset({('CHEBI', 1), ('INCHIKEY', 1), ('UMLS', 1), ('RXCUI', 1), ('MESH', 1), ('DRUGBANK', 1), ('CHEMBL.COMPOUND', 1), ('HMDB', 1)}) 1 frozenset({('CHEBI', 1), ('GTOPDB', 1), ('INCHIKEY', 1), ('UNII', 1), ('UMLS', 1), ('RXCUI', 1), ('MESH', 1), ('DRUGBANK', 1), ('CHEMBL.COMPOUND', 1), ('HMDB', 1)}) 1 frozenset({('RXCUI', 2), ('CHEBI', 1), ('DRUGCENTRAL', 1), ('UNII', 1), ('KEGG.COMPOUND', 1), ('MESH', 1), ('DRUGBANK', 1), ('CHEMBL.COMPOUND', 1), ('UMLS', 2)}) 1 frozenset({('DRUGBANK', 7), ('UMLS', 1)}) 1 frozenset({('DRUGCENTRAL', 1), ('UMLS', 1), ('RXCUI', 1), ('CHEMBL.COMPOUND', 2), ('DRUGBANK', 1)}) 1 frozenset({('DRUGCENTRAL', 1), ('UMLS', 1), ('RXCUI', 1), ('DRUGBANK', 1), ('UNII', 2), ('INCHIKEY', 1)}) 1 frozenset({('DRUGCENTRAL', 1), ('UNII', 1), ('RXCUI', 1), ('MESH', 1), ('DRUGBANK', 1), ('CHEMBL.COMPOUND', 1), ('UMLS', 2)}) 1 frozenset({('INCHIKEY', 1), ('MESH', 1), ('CHEBI', 1), ('UNII', 1)}) 1 frozenset({('MESH', 2), ('UNII', 1), ('DRUGBANK', 1), ('UMLS', 2), ('INCHIKEY', 1)}) 1 frozenset({('DRUGCENTRAL', 1), ('UNII', 1), ('UMLS', 1), ('RXCUI', 1), ('MESH', 1), ('CHEBI', 2), ('DRUGBANK', 1), ('CHEMBL.COMPOUND', 1), ('INCHIKEY', 1)}) 1 frozenset({('RXCUI', 2), ('DRUGCENTRAL', 1), ('UNII', 1), ('MESH', 2), ('DRUGBANK', 2), ('CHEMBL.COMPOUND', 2), ('UMLS', 2)}) 1 frozenset({('DRUGCENTRAL', 1), ('GTOPDB', 1), ('DRUGBANK', 3), ('UNII', 2), ('CHEMBL.COMPOUND', 5), ('UMLS', 3), ('RXCUI', 3), ('MESH', 3)}) 1 frozenset({('CHEBI', 1), ('DRUGCENTRAL', 1), ('GTOPDB', 1), ('UNII', 1), ('UMLS', 1), ('RXCUI', 1), ('CHEMBL.COMPOUND', 2), ('MESH', 1), ('DRUGBANK', 1)}) 1 frozenset({('CHEBI', 1), ('UMLS', 1), ('MESH', 1), ('CAS', 1), ('INCHIKEY', 1)}) 1 frozenset({('DRUGCENTRAL', 1), ('UMLS', 1), ('UNII', 1), ('MESH', 1), ('CHEMBL.COMPOUND', 1)}) 1 frozenset({('CHEBI', 1), ('UMLS', 1), ('MESH', 1), ('CAS', 1), ('DRUGBANK', 1), ('INCHIKEY', 1)}) 1 frozenset({('UNII', 1), ('UMLS', 1), ('KEGG.COMPOUND', 1), ('RXCUI', 1), ('DRUGBANK', 1), ('CHEMBL.COMPOUND', 1), ('INCHIKEY', 1)}) 1 frozenset({('CHEBI', 1), ('UMLS', 1), ('UNII', 1), ('KEGG.COMPOUND', 1), ('MESH', 1)}) 1 frozenset({('DRUGBANK', 1)}) 1 frozenset({('CHEBI', 1), ('DRUGCENTRAL', 1), ('UNII', 1), ('UMLS', 1), ('KEGG.COMPOUND', 1), ('RXCUI', 1), ('MESH', 1), ('CAS', 1), ('DRUGBANK', 1)}) 1 frozenset({('UNII', 1), ('RXCUI', 1), ('MESH', 1), ('DRUGBANK', 1), ('INCHIKEY', 1)}) 1 frozenset({('UNII', 1), ('KEGG.COMPOUND', 1), ('HMDB', 1), ('DRUGBANK', 1), ('INCHIKEY', 1)}) 1 frozenset({('DRUGCENTRAL', 1), ('UNII', 1), ('UMLS', 1), ('PUBCHEM.COMPOUND', 1), ('CHEMBL.COMPOUND', 1), ('INCHIKEY', 1)}) 1 frozenset({('CHEBI', 1), ('DRUGCENTRAL', 1), ('UNII', 1), ('UMLS', 1), ('RXCUI', 1), ('MESH', 1), ('DRUGBANK', 1), ('INCHIKEY', 1)}) 1 frozenset({('CHEBI', 1), ('DRUGCENTRAL', 1), ('UNII', 1), ('DRUGBANK', 1), ('CHEMBL.COMPOUND', 1), ('INCHIKEY', 1)}) 1 frozenset({('UMLS', 1), ('MESH', 1), ('CHEBI', 1), ('INCHIKEY', 1)}) 1 frozenset({('UMLS', 1), ('RXCUI', 1), ('DRUGBANK', 1), ('CHEMBL.COMPOUND', 1), ('INCHIKEY', 1)}) 1 frozenset({('CHEBI', 1), ('DRUGCENTRAL', 1), ('UNII', 1), ('UMLS', 1), ('KEGG.COMPOUND', 1), ('RXCUI', 1), ('MESH', 1), ('DRUGBANK', 1), ('CHEMBL.COMPOUND', 1), ('INCHIKEY', 1)}) 1 frozenset({('DRUGCENTRAL', 1), ('UNII', 1), ('MESH', 2), ('UMLS', 1), ('RXCUI', 1), ('CHEMBL.COMPOUND', 2), ('DRUGBANK', 1)}) 1 frozenset({('DRUGCENTRAL', 1), ('UNII', 1), ('UMLS', 1), ('RXCUI', 1), ('MESH', 1), ('CAS', 1), ('DRUGBANK', 1), ('CHEMBL.COMPOUND', 1)}) 1 frozenset({('KEGG.COMPOUND', 1), ('INCHIKEY', 1), ('PUBCHEM.COMPOUND', 1)}) 1 frozenset({('CHEBI', 1), ('DRUGCENTRAL', 1), ('MESH', 2), ('UNII', 1), ('RXCUI', 1), ('UMLS', 3), ('DRUGBANK', 1), ('CHEMBL.COMPOUND', 1), ('INCHIKEY', 1)}) 1 frozenset({('CHEBI', 1), ('UNII', 1), ('UMLS', 1), ('RXCUI', 1), ('DRUGBANK', 1), ('CHEMBL.COMPOUND', 1), ('INCHIKEY', 1)}) 1 frozenset({('RXCUI', 2), ('DRUGCENTRAL', 1), ('UNII', 1), ('UMLS', 1), ('DRUGBANK', 2), ('CHEMBL.COMPOUND', 2), ('MESH', 1)}) 1 frozenset({('CHEBI', 1), ('UNII', 1), ('UMLS', 1), ('DRUGBANK', 1), ('CHEMBL.COMPOUND', 1), ('INCHIKEY', 1)}) 1 frozenset({('CHEBI', 1), ('INCHIKEY', 1)}) 2 frozenset({('CHEBI', 1), ('UMLS', 1), ('UNII', 1), ('MESH', 1), ('INCHIKEY', 1)}) 2 frozenset({('CHEBI', 1), ('GTOPDB', 1), ('UNII', 1), ('UMLS', 1), ('KEGG.COMPOUND', 1), ('MESH', 1), ('DRUGBANK', 1), ('CHEMBL.COMPOUND', 1), ('INCHIKEY', 1)}) 2 frozenset({('CHEBI', 1), ('UNII', 1), ('UMLS', 1), ('RXCUI', 1), ('MESH', 1), ('DRUGBANK', 1), ('CHEMBL.COMPOUND', 1), ('INCHIKEY', 1)}) 2 frozenset({('DRUGCENTRAL', 1), ('UNII', 1), ('UMLS', 1), ('CHEMBL.COMPOUND', 2), ('MESH', 1), ('DRUGBANK', 1)}) 2 frozenset({('DRUGBANK', 1), ('RXCUI', 1), ('UMLS', 2)}) 2 frozenset({('DRUGCENTRAL', 1), ('MESH', 2), ('UNII', 1), ('RXCUI', 1), ('DRUGBANK', 1), ('CHEMBL.COMPOUND', 1), ('UMLS', 2)}) 2 frozenset({('CHEMBL.COMPOUND', 1), ('UMLS', 1), ('DRUGCENTRAL', 1)}) 2 frozenset({('DRUGCENTRAL', 1), ('GTOPDB', 1), ('UNII', 1), ('MESH', 2), ('UMLS', 1), ('RXCUI', 1), ('CHEMBL.COMPOUND', 2), ('DRUGBANK', 1)}) 2 frozenset({('DRUGCENTRAL', 1), ('GTOPDB', 1), ('UNII', 1), ('UMLS', 1), ('DRUGBANK', 1), ('CHEMBL.COMPOUND', 1)}) 2 frozenset({('DRUGCENTRAL', 1), ('UMLS', 1), ('UNII', 1), ('RXCUI', 1), ('MESH', 1), ('CHEMBL.COMPOUND', 1)}) 2 frozenset({('DRUGBANK', 1), ('MESH', 1), ('RXCUI', 1), ('UMLS', 2)}) 2 frozenset({('DRUGCENTRAL', 1), ('UMLS', 1), ('UNII', 1), ('RXCUI', 1), ('CHEMBL.COMPOUND', 1), ('INCHIKEY', 1)}) 2 frozenset({('CHEBI', 1), ('GTOPDB', 1), ('UNII', 1), ('UMLS', 1), ('MESH', 1), ('DRUGBANK', 1), ('CHEMBL.COMPOUND', 1), ('INCHIKEY', 1)}) 2 frozenset({('CHEBI', 1), ('UNII', 1), ('UMLS', 1), ('KEGG.COMPOUND', 1), ('MESH', 1), ('INCHIKEY', 1)}) 2 frozenset({('DRUGCENTRAL', 1), ('UNII', 1), ('UMLS', 1), ('RXCUI', 1), ('CHEMBL.COMPOUND', 2), ('DRUGBANK', 1)}) 2 frozenset({('CHEBI', 1), ('DRUGCENTRAL', 1), ('UMLS', 1), ('KEGG.COMPOUND', 1), ('RXCUI', 1), ('MESH', 1), ('DRUGBANK', 1), ('CHEMBL.COMPOUND', 1)}) 2 frozenset({('RXCUI', 1), ('DRUGBANK', 8), ('UMLS', 1)}) 2 frozenset({('RXCUI', 1), ('DRUGBANK', 2), ('MESH', 1), ('UMLS', 1)}) 2 frozenset({('CHEBI', 1), ('UMLS', 1), ('RXCUI', 1), ('MESH', 1), ('CAS', 1)}) 2 frozenset({('UMLS', 1), ('MESH', 1), ('CHEBI', 1), ('UNII', 1)}) 2 frozenset({('RXCUI', 1), ('UMLS', 1), ('DRUGBANK', 6)}) 2 frozenset({('CHEMBL.COMPOUND', 1), ('UMLS', 1), ('UNII', 1), ('DRUGCENTRAL', 1)}) 2 frozenset({('DRUGCENTRAL', 1), ('UNII', 1), ('UMLS', 1), ('DRUGBANK', 1), ('CHEMBL.COMPOUND', 1), ('INCHIKEY', 1)}) 2 frozenset({('CHEBI', 1), ('INCHIKEY', 1), ('UNII', 1), ('UMLS', 1), ('KEGG.COMPOUND', 1), ('MESH', 1), ('CHEMBL.COMPOUND', 1), ('HMDB', 1)}) 2 frozenset({('UNII', 1), ('UMLS', 1), ('RXCUI', 1), ('MESH', 1), ('DRUGBANK', 1), ('INCHIKEY', 1)}) 2 frozenset({('DRUGCENTRAL', 1), ('UMLS', 1), ('CHEMBL.COMPOUND', 3), ('RXCUI', 1), ('DRUGBANK', 1)}) 2 frozenset({('CHEMBL.COMPOUND', 1), ('UNII', 1), ('INCHIKEY', 1), ('KEGG.COMPOUND', 1)}) 2 frozenset({('GTOPDB', 1), ('UNII', 1), ('UMLS', 1), ('MESH', 1), ('CHEMBL.COMPOUND', 1), ('INCHIKEY', 1)}) 2 frozenset({('CHEBI', 1), ('INCHIKEY', 1), ('UNII', 1), ('UMLS', 1), ('KEGG.COMPOUND', 1), ('MESH', 1), ('DRUGBANK', 1), ('HMDB', 1)}) 2 frozenset({('DRUGCENTRAL', 1), ('UNII', 1), ('UMLS', 1), ('MESH', 1), ('DRUGBANK', 1), ('CHEMBL.COMPOUND', 1)}) 3 frozenset({('CHEBI', 1), ('UNII', 1), ('UMLS', 1), ('RXCUI', 1), ('MESH', 1), ('CHEMBL.COMPOUND', 1), ('INCHIKEY', 1)}) 3 frozenset({('CHEBI', 1), ('DRUGCENTRAL', 1), ('GTOPDB', 1), ('UNII', 1), ('UMLS', 1), ('KEGG.COMPOUND', 1), ('RXCUI', 1), ('MESH', 1), ('DRUGBANK', 1), ('CHEMBL.COMPOUND', 1), ('INCHIKEY', 1)}) 3 frozenset({('CHEBI', 1), ('DRUGCENTRAL', 1), ('INCHIKEY', 1), ('UNII', 1), ('UMLS', 1), ('RXCUI', 1), ('MESH', 1), ('DRUGBANK', 1), ('CHEMBL.COMPOUND', 1), ('HMDB', 1)}) 3 frozenset({('UMLS', 1), ('DRUGBANK', 4)}) 3 frozenset({('RXCUI', 1), ('UMLS', 1), ('DRUGBANK', 4)}) 3 frozenset({('DRUGBANK', 1), ('INCHIKEY', 1), ('CHEBI', 1), ('UNII', 1)}) 3 frozenset({('CHEBI', 1), ('DRUGCENTRAL', 1), ('UNII', 1), ('UMLS', 1), ('RXCUI', 1), ('DRUGBANK', 1), ('CHEMBL.COMPOUND', 1), ('INCHIKEY', 1)}) 3 frozenset({('UNII', 1), ('INCHIKEY', 1), ('KEGG.COMPOUND', 1)}) 3 frozenset({('INCHIKEY', 1), ('CHEBI', 1), ('UNII', 1), ('KEGG.COMPOUND', 1)}) 3 frozenset({('CHEBI', 1), ('INCHIKEY', 1), ('UNII', 1), ('UMLS', 1), ('KEGG.COMPOUND', 1), ('RXCUI', 1), ('MESH', 1), ('DRUGBANK', 1), ('CHEMBL.COMPOUND', 1), ('HMDB', 1)}) 3 frozenset({('KEGG.COMPOUND', 2), ('MESH', 1), ('CHEBI', 1), ('UMLS', 1)}) 3 frozenset({('UMLS', 1), ('DRUGCENTRAL', 1)}) 3 frozenset({('CHEBI', 1), ('UNII', 1), ('UMLS', 1), ('KEGG.COMPOUND', 1), ('MESH', 1), ('DRUGBANK', 1), ('CHEMBL.COMPOUND', 1), ('INCHIKEY', 1)}) 3 frozenset({('DRUGBANK', 1), ('INCHIKEY', 1), ('UNII', 1), ('HMDB', 1)}) 3 frozenset({('UMLS', 1), ('UNII', 1), ('RXCUI', 1), ('DRUGBANK', 2), ('MESH', 1)}) 3 frozenset({('KEGG.COMPOUND', 2), ('CHEBI', 1)}) 3 frozenset({('DRUGBANK', 1), ('CHEMBL.COMPOUND', 1), ('UMLS', 1), ('INCHIKEY', 1)}) 4 frozenset({('CHEBI', 1), ('DRUGCENTRAL', 1), ('UNII', 1), ('UMLS', 1), ('MESH', 1), ('DRUGBANK', 1), ('CHEMBL.COMPOUND', 1), ('INCHIKEY', 1)}) 4 frozenset({('CHEBI', 1), ('DRUGCENTRAL', 1), ('GTOPDB', 1), ('UNII', 1), ('UMLS', 1), ('RXCUI', 1), ('MESH', 1), ('DRUGBANK', 1), ('CHEMBL.COMPOUND', 1), ('INCHIKEY', 1)}) 4 frozenset({('DRUGCENTRAL', 1), ('MESH', 2), ('UNII', 1), ('UMLS', 1), ('RXCUI', 1), ('DRUGBANK', 1), ('CHEMBL.COMPOUND', 1)}) 4 frozenset({('CHEBI', 1), ('UMLS', 1), ('KEGG.COMPOUND', 1), ('RXCUI', 1), ('MESH', 1)}) 4 frozenset({('DRUGCENTRAL', 1), ('UNII', 1), ('UMLS', 1), ('RXCUI', 1), ('DRUGBANK', 1), ('CHEMBL.COMPOUND', 1), ('INCHIKEY', 1)}) 4 frozenset({('CHEBI', 1), ('UMLS', 1), ('KEGG.COMPOUND', 1), ('MESH', 1), ('CAS', 1)}) 4 frozenset({('UNII', 1), ('INCHIKEY', 1), ('PUBCHEM.COMPOUND', 1)}) 4 frozenset({('UNII', 1), ('MESH', 1), ('DRUGBANK', 1), ('CHEMBL.COMPOUND', 1), ('INCHIKEY', 1)}) 4 frozenset({('DRUGBANK', 1), ('RXCUI', 1), ('UMLS', 1), ('INCHIKEY', 1)}) 5 frozenset({('DRUGCENTRAL', 1), ('UMLS', 1), ('UNII', 1), ('DRUGBANK', 1), ('CHEMBL.COMPOUND', 1)}) 5 frozenset({('UNII', 1), ('UMLS', 1), ('MESH', 1), ('DRUGBANK', 1), ('INCHIKEY', 1)}) 6 frozenset({('DRUGCENTRAL', 1), ('UNII', 1), ('UMLS', 1), ('RXCUI', 1), ('CHEMBL.COMPOUND', 2), ('MESH', 1), ('DRUGBANK', 1)}) 6 frozenset({('CHEMBL.COMPOUND', 1), ('UNII', 1), ('INCHIKEY', 1)}) 7 frozenset({('CHEBI', 1), ('UNII', 1), ('UMLS', 1), ('MESH', 1), ('CHEMBL.COMPOUND', 1), ('INCHIKEY', 1)}) 7 frozenset({('UMLS', 1), ('UNII', 1), ('RXCUI', 1), ('DRUGBANK', 1), ('CHEMBL.COMPOUND', 1), ('INCHIKEY', 1)}) 7 frozenset({('RXCUI', 1), ('DRUGBANK', 3), ('UMLS', 1)}) 7 frozenset({('UMLS', 1), ('UNII', 1), ('HMDB', 1), ('MESH', 1), ('INCHIKEY', 1)}) 7 frozenset({('CHEBI', 1), ('DRUGCENTRAL', 1), ('UNII', 1), ('UMLS', 1), ('RXCUI', 1), ('MESH', 1), ('DRUGBANK', 1), ('CHEMBL.COMPOUND', 1), ('INCHIKEY', 1)}) 7 frozenset({('RXCUI', 1), ('UMLS', 1), ('DRUGBANK', 5)}) 8 frozenset({('DRUGBANK', 2), ('UMLS', 1)}) 8 frozenset({('UMLS', 1), ('MESH', 1), ('CHEBI', 1), ('RXCUI', 1)}) 8 frozenset({('CHEBI', 1), ('DRUGCENTRAL', 1), ('INCHIKEY', 1), ('UNII', 1), ('UMLS', 1), ('KEGG.COMPOUND', 1), ('RXCUI', 1), ('MESH', 1), ('DRUGBANK', 1), ('CHEMBL.COMPOUND', 1), ('HMDB', 1)}) 9 frozenset({('DRUGCENTRAL', 1), ('GTOPDB', 1), ('UNII', 1), ('UMLS', 1), ('RXCUI', 1), ('CHEMBL.COMPOUND', 2), ('MESH', 1), ('DRUGBANK', 1)}) 9 frozenset({('DRUGBANK', 1), ('MESH', 1), ('UMLS', 1), ('CAS', 1)}) 10 frozenset({('DRUGCENTRAL', 1), ('GTOPDB', 1), ('UNII', 1), ('UMLS', 1), ('RXCUI', 1), ('DRUGBANK', 1), ('CHEMBL.COMPOUND', 1)}) 11 frozenset({('UMLS', 1), ('MESH', 2)}) 11 frozenset({('CHEMBL.COMPOUND', 1), ('MESH', 1), ('UNII', 1), ('INCHIKEY', 1)}) 11 frozenset({('UMLS', 1), ('UNII', 1), ('RXCUI', 1), ('DRUGBANK', 1), ('INCHIKEY', 1)}) 12 frozenset({('UMLS', 1), ('RXCUI', 1), ('MESH', 1), ('CAS', 1), ('DRUGBANK', 1)}) 13 frozenset({('CHEBI', 1), ('UNII', 1), ('UMLS', 1), ('KEGG.COMPOUND', 1), ('MESH', 1), ('CHEMBL.COMPOUND', 1), ('INCHIKEY', 1)}) 13 frozenset({('UNII', 1), ('UMLS', 1), ('MESH', 1), ('DRUGBANK', 1), ('CHEMBL.COMPOUND', 1), ('INCHIKEY', 1)}) 13 frozenset({('GTOPDB', 1), ('UNII', 1), ('UMLS', 1), ('DRUGBANK', 1), ('CHEMBL.COMPOUND', 1), ('INCHIKEY', 1)}) 15 frozenset({('MESH', 1), ('CHEBI', 1), ('KEGG.COMPOUND', 1)}) 15 frozenset({('MESH', 1), ('UNII', 1), ('INCHIKEY', 1)}) 15 frozenset({('UMLS', 1), ('UNII', 1), ('RXCUI', 1), ('MESH', 1), ('CHEMBL.COMPOUND', 1), ('INCHIKEY', 1)}) 15 frozenset({('DRUGBANK', 1), ('UMLS', 1), ('UNII', 1), ('INCHIKEY', 1)}) 17 frozenset({('DRUGCENTRAL', 1), ('GTOPDB', 1), ('MESH', 2), ('UNII', 1), ('UMLS', 1), ('RXCUI', 1), ('DRUGBANK', 1), ('CHEMBL.COMPOUND', 1)}) 18 frozenset({('DRUGBANK', 1), ('UMLS', 1), ('INCHIKEY', 1)}) 18 frozenset({('DRUGCENTRAL', 1), ('UMLS', 1), ('UNII', 1), ('RXCUI', 1), ('DRUGBANK', 1), ('CHEMBL.COMPOUND', 1)}) 20 frozenset({('RXCUI', 1), ('DRUGBANK', 2), ('UMLS', 1)}) 20 frozenset({('UMLS', 1), ('UNII', 1), ('RXCUI', 1), ('MESH', 1), ('INCHIKEY', 1)}) 22 frozenset({('DRUGCENTRAL', 1), ('UNII', 1), ('UMLS', 1), ('RXCUI', 1), ('MESH', 1), ('DRUGBANK', 1), ('CHEMBL.COMPOUND', 1)}) 31 frozenset({('RXCUI', 1), ('MESH', 1), ('UMLS', 1), ('CAS', 1)}) 31 frozenset({('UMLS', 1), ('UNII', 1), ('DRUGBANK', 1), ('CHEMBL.COMPOUND', 1), ('INCHIKEY', 1)}) 33 frozenset({('CHEMBL.COMPOUND', 1), ('INCHIKEY', 1)}) 40 frozenset({('DRUGBANK', 1), ('MESH', 1), ('UMLS', 1), ('RXCUI', 1)}) 40 frozenset({('DRUGBANK', 1), ('UNII', 1), ('INCHIKEY', 1)}) 44 frozenset({('DRUGBANK', 1), ('CHEMBL.COMPOUND', 1), ('UNII', 1), ('INCHIKEY', 1)}) 44 frozenset({('UMLS', 1), ('MESH', 1), ('CHEBI', 1), ('KEGG.COMPOUND', 1)}) 57 frozenset({('UMLS', 1), ('UNII', 1), ('MESH', 1), ('CHEMBL.COMPOUND', 1), ('INCHIKEY', 1)}) 62 frozenset({('UNII', 1), ('UMLS', 1), ('RXCUI', 1), ('MESH', 1), ('DRUGBANK', 1)}) 62 frozenset({('DRUGCENTRAL', 1), ('GTOPDB', 1), ('UNII', 1), ('UMLS', 1), ('RXCUI', 1), ('MESH', 1), ('DRUGBANK', 1), ('CHEMBL.COMPOUND', 1)}) 98 frozenset({('INCHIKEY', 1), ('KEGG.COMPOUND', 1)}) 99 frozenset({('UMLS', 1), ('MESH', 1), ('UNII', 1), ('INCHIKEY', 1)}) 99 frozenset({('DRUGBANK', 1), ('RXCUI', 1)}) 105 frozenset({('UMLS', 1), ('MESH', 1), ('UNII', 1), ('RXCUI', 1)}) 157 frozenset({('DRUGBANK', 1), ('MESH', 1), ('UMLS', 1)}) 161 frozenset({('MESH', 1), ('CHEBI', 1)}) 187 frozenset({('MESH', 1), ('UNII', 1)}) 187 frozenset({('RXCUI', 1), ('MESH', 1), ('UMLS', 1)}) 192 frozenset({('DRUGBANK', 1), ('INCHIKEY', 1)}) 205 frozenset({('DRUGBANK', 1), ('MESH', 1), ('UNII', 1), ('UMLS', 1)}) 251 frozenset({('UMLS', 1), ('MESH', 1), ('UNII', 1)}) 255 frozenset({('UMLS', 1), ('MESH', 1), ('CHEBI', 1)}) 312 frozenset({('KEGG.COMPOUND', 1)}) 314 frozenset({('CHEBI', 1), ('KEGG.COMPOUND', 1)}) 457 frozenset({('RXCUI', 1)}) 780 frozenset({('DRUGBANK', 1), ('UMLS', 1), ('RXCUI', 1)}) 963 frozenset({('DRUGBANK', 1), ('UMLS', 1)}) 1726 frozenset({('MESH', 1), ('CAS', 1)}) 3755 frozenset({('MESH', 1), ('UMLS', 1), ('CAS', 1)}) 4614 frozenset({('UNII', 1), ('INCHIKEY', 1)}) 4678 frozenset({('CHEBI', 1)}) 9890 frozenset({('RXCUI', 1), ('UMLS', 1)}) 10517 frozenset({('CHEMBL.COMPOUND', 1)}) 20833 frozenset({('INCHIKEY', 1), ('PUBCHEM.COMPOUND', 1)}) 43739 frozenset({('UNII', 1)}) 46662 frozenset({('MESH', 1)}) 67298 frozenset({('MESH', 1), ('UMLS', 1)}) 92210 frozenset({('UMLS', 1)}) 173445