112039197 clusters Max cluster size: 129 Cluster Size Distribution 1 146363 2 105099978 3 6182156 4 456661 5 86372 6 29684 7 13838 8 7704 9 5015 10 3384 11 2480 12 1645 13 1205 14 865 15 644 16 400 17 300 18 159 19 104 20 74 21 54 22 26 23 17 24 18 25 15 26 9 27 7 28 4 29 1 30 1 31 3 35 1 36 2 37 1 40 1 41 2 42 2 47 1 129 1 Cluster Type Distribution frozenset({('CHEMBL.COMPOUND', 1), ('DRUGCENTRAL', 1), ('PUBCHEM.COMPOUND', 1), ('CHEBI', 5), ('CAS', 3), ('UNII', 1), ('INCHIKEY', 1), ('KEGG.COMPOUND', 2), ('MESH', 1)}) 1 frozenset({('CHEMBL.COMPOUND', 1), ('DRUGCENTRAL', 1), ('UMLS', 2), ('RXCUI', 2), ('PUBCHEM.COMPOUND', 1), ('CHEBI', 1), ('UNII', 1), ('INCHIKEY', 1), ('CAS', 2), ('MESH', 1)}) 1 frozenset({('CAS', 1), ('CHEMBL.COMPOUND', 1), ('INCHIKEY', 1), ('PUBCHEM.COMPOUND', 3), ('MESH', 2)}) 1 frozenset({('CHEMBL.COMPOUND', 1), ('DRUGCENTRAL', 1), ('UNII', 2), ('PUBCHEM.COMPOUND', 1), ('CAS', 3), ('UMLS', 1), ('INCHIKEY', 1), ('DRUGBANK', 1), ('HMDB', 1), ('MESH', 1)}) 1 frozenset({('CAS', 1), ('CHEMBL.COMPOUND', 1), ('CHEBI', 2), ('UNII', 1), ('UMLS', 1), ('INCHIKEY', 1), ('DRUGBANK', 1), ('PUBCHEM.COMPOUND', 3), ('MESH', 1)}) 1 frozenset({('PUBCHEM.COMPOUND', 1), ('CAS', 3), ('UNII', 1), ('UMLS', 1), ('INCHIKEY', 1), ('DRUGBANK', 1)}) 1 frozenset({('CHEMBL.COMPOUND', 1), ('CAS', 3), ('UNII', 1), ('UMLS', 1), ('INCHIKEY', 1), ('RXCUI', 1), ('PUBCHEM.COMPOUND', 2), ('MESH', 1)}) 1 frozenset({('CHEMBL.COMPOUND', 1), ('GTOPDB', 1), ('UNII', 1), ('INCHIKEY', 1), ('DRUGBANK', 1), ('PUBCHEM.COMPOUND', 3), ('CAS', 2), ('HMDB', 1), ('CHEBI', 3)}) 1 frozenset({('PUBCHEM.COMPOUND', 8), ('INCHIKEY', 1), ('HMDB', 1)}) 1 frozenset({('CHEMBL.COMPOUND', 1), ('UMLS', 2), ('CHEBI', 1), ('UNII', 1), ('CAS', 3), ('INCHIKEY', 1), ('DRUGBANK', 1), ('HMDB', 1), ('PUBCHEM.COMPOUND', 2), ('KEGG.COMPOUND', 1), ('MESH', 1)}) 1 frozenset({('CAS', 1), ('CHEMBL.COMPOUND', 1), ('CHEBI', 8), ('PUBCHEM.COMPOUND', 1), ('UMLS', 1), ('INCHIKEY', 1), ('KEGG.COMPOUND', 1), ('MESH', 1)}) 1 frozenset({('CHEMBL.COMPOUND', 1), ('UNII', 2), ('PUBCHEM.COMPOUND', 1), ('INCHIKEY', 1), ('CAS', 2), ('MESH', 1)}) 1 frozenset({('CHEMBL.COMPOUND', 1), ('DRUGCENTRAL', 1), ('UMLS', 2), ('PUBCHEM.COMPOUND', 1), ('GTOPDB', 1), ('UNII', 1), ('INCHIKEY', 1), ('DRUGBANK', 1), ('CAS', 2), ('MESH', 1)}) 1 frozenset({('CHEMBL.COMPOUND', 1), ('PUBCHEM.COMPOUND', 1), ('CHEBI', 5), ('CAS', 3), ('INCHIKEY', 1), ('KEGG.COMPOUND', 1)}) 1 frozenset({('DRUGCENTRAL', 1), ('CHEBI', 1), ('UNII', 1), ('UMLS', 1), ('INCHIKEY', 1), ('DRUGBANK', 1), ('KEGG.COMPOUND', 1), ('CAS', 2), ('CHEMBL.COMPOUND', 2), ('RXCUI', 1), ('PUBCHEM.COMPOUND', 5), ('MESH', 1)}) 1 frozenset({('CAS', 1), ('CHEMBL.COMPOUND', 1), ('UMLS', 2), ('PUBCHEM.COMPOUND', 1), ('CHEBI', 5), ('UNII', 1), ('INCHIKEY', 1), ('DRUGBANK', 1), ('RXCUI', 1), ('HMDB', 1), ('KEGG.COMPOUND', 1), ('MESH', 1)}) 1 frozenset({('CAS', 1), ('CHEMBL.COMPOUND', 1), ('CHEBI', 2), ('DRUGCENTRAL', 1), ('PUBCHEM.COMPOUND', 1), ('UNII', 1), ('INCHIKEY', 1)}) 1 frozenset({('CAS', 1), ('DRUGCENTRAL', 1), ('UMLS', 2), ('UNII', 1), ('INCHIKEY', 1), ('DRUGBANK', 1), ('CHEMBL.COMPOUND', 2), ('RXCUI', 1), ('PUBCHEM.COMPOUND', 2), ('MESH', 1)}) 1 frozenset({('CHEMBL.COMPOUND', 1), ('DRUGCENTRAL', 1), ('PUBCHEM.COMPOUND', 1), ('CHEBI', 1), ('UNII', 1), ('UMLS', 1), ('INCHIKEY', 1), ('DRUGBANK', 1), ('CAS', 2), ('RXCUI', 1), ('KEGG.COMPOUND', 2), ('MESH', 1)}) 1 frozenset({('CAS', 1), ('CHEMBL.COMPOUND', 1), ('PUBCHEM.COMPOUND', 1), ('INCHIKEY', 1), ('KEGG.COMPOUND', 1), ('CHEBI', 3), ('MESH', 1)}) 1 frozenset({('DRUGCENTRAL', 1), ('PUBCHEM.COMPOUND', 1), ('CHEBI', 1), ('UMLS', 1), ('INCHIKEY', 1), ('DRUGBANK', 1), ('RXCUI', 1), ('MESH', 1)}) 1 frozenset({('CAS', 1), ('CHEMBL.COMPOUND', 1), ('PUBCHEM.COMPOUND', 1), ('UNII', 1), ('INCHIKEY', 1), ('HMDB', 1), ('KEGG.COMPOUND', 1), ('RXCUI', 1), ('MESH', 2), ('CHEBI', 3), ('UMLS', 2)}) 1 frozenset({('CAS', 1), ('CHEBI', 2), ('UMLS', 1), ('INCHIKEY', 1), ('PUBCHEM.COMPOUND', 3), ('MESH', 1)}) 1 frozenset({('CHEBI', 1), ('UNII', 1), ('CAS', 3), ('INCHIKEY', 1), ('UMLS', 1), ('PUBCHEM.COMPOUND', 2), ('MESH', 1)}) 1 frozenset({('PUBCHEM.COMPOUND', 1), ('CHEBI', 5), ('CAS', 3), ('UMLS', 1), ('INCHIKEY', 1), ('DRUGBANK', 1), ('RXCUI', 1), ('KEGG.COMPOUND', 1), ('MESH', 1)}) 1 frozenset({('PUBCHEM.COMPOUND', 1), ('CHEBI', 1), ('CAS', 3), ('UMLS', 1), ('INCHIKEY', 1), ('DRUGBANK', 1), ('RXCUI', 1), ('HMDB', 1), ('MESH', 1)}) 1 frozenset({('CHEBI', 2), ('UNII', 1), ('UMLS', 1), ('INCHIKEY', 1), ('PUBCHEM.COMPOUND', 3), ('CAS', 2), ('RXCUI', 1), ('MESH', 1)}) 1 frozenset({('CAS', 1), ('CHEMBL.COMPOUND', 1), ('INCHIKEY', 1), ('DRUGBANK', 1), ('PUBCHEM.COMPOUND', 2), ('CHEBI', 3)}) 1 frozenset({('DRUGCENTRAL', 1), ('UMLS', 2), ('PUBCHEM.COMPOUND', 1), ('CHEBI', 1), ('UNII', 1), ('INCHIKEY', 1), ('DRUGBANK', 1), ('CAS', 2), ('RXCUI', 1), ('HMDB', 1), ('MESH', 1)}) 1 frozenset({('CAS', 1), ('CHEMBL.COMPOUND', 1), ('CHEBI', 2), ('PUBCHEM.COMPOUND', 1), ('UNII', 1), ('UMLS', 1), ('INCHIKEY', 1), ('DRUGBANK', 1), ('HMDB', 1), ('KEGG.COMPOUND', 1)}) 1 frozenset({('DRUGCENTRAL', 1), ('CHEBI', 2), ('GTOPDB', 1), ('PUBCHEM.COMPOUND', 1), ('INCHIKEY', 1), ('HMDB', 1), ('KEGG.COMPOUND', 1), ('MESH', 1)}) 1 frozenset({('CHEMBL.COMPOUND', 1), ('DRUGCENTRAL', 1), ('PUBCHEM.COMPOUND', 1), ('CHEBI', 1), ('UNII', 1), ('UMLS', 1), ('INCHIKEY', 1), ('DRUGBANK', 1), ('CAS', 2), ('MESH', 2)}) 1 frozenset({('PUBCHEM.COMPOUND', 1), ('GTOPDB', 1), ('CHEBI', 1), ('UNII', 1), ('CAS', 3), ('INCHIKEY', 1), ('UMLS', 1), ('HMDB', 1), ('KEGG.COMPOUND', 1), ('MESH', 1)}) 1 frozenset({('PUBCHEM.COMPOUND', 13), ('CHEMBL.COMPOUND', 1), ('INCHIKEY', 1), ('HMDB', 1)}) 1 frozenset({('CHEMBL.COMPOUND', 1), ('GTOPDB', 1), ('CHEBI', 1), ('UMLS', 1), ('INCHIKEY', 1), ('CAS', 2), ('PUBCHEM.COMPOUND', 2), ('MESH', 1)}) 1 frozenset({('GTOPDB', 2), ('CHEMBL.COMPOUND', 1), ('CHEBI', 2), ('PUBCHEM.COMPOUND', 1), ('UNII', 1), ('INCHIKEY', 1), ('CAS', 2), ('KEGG.COMPOUND', 1)}) 1 frozenset({('CHEMBL.COMPOUND', 1), ('CHEBI', 2), ('DRUGCENTRAL', 1), ('PUBCHEM.COMPOUND', 1), ('UNII', 1), ('UMLS', 1), ('INCHIKEY', 1), ('DRUGBANK', 1), ('CAS', 2), ('GTOPDB', 3), ('RXCUI', 1), ('HMDB', 1), ('MESH', 1)}) 1 frozenset({('PUBCHEM.COMPOUND', 1), ('CHEBI', 1), ('UNII', 1), ('UMLS', 1), ('INCHIKEY', 1), ('DRUGBANK', 1), ('CAS', 2), ('MESH', 2), ('KEGG.COMPOUND', 1)}) 1 frozenset({('CAS', 1), ('CHEBI', 1), ('UNII', 1), ('UMLS', 1), ('INCHIKEY', 1), ('DRUGBANK', 1), ('RXCUI', 1), ('HMDB', 1), ('PUBCHEM.COMPOUND', 2), ('MESH', 1)}) 1 frozenset({('INCHIKEY', 1), ('CAS', 4), ('MESH', 1), ('PUBCHEM.COMPOUND', 1)}) 1 frozenset({('CHEMBL.COMPOUND', 1), ('CAS', 4), ('DRUGCENTRAL', 1), ('PUBCHEM.COMPOUND', 1), ('UNII', 1), ('UMLS', 1), ('INCHIKEY', 1), ('DRUGBANK', 1), ('CHEBI', 7), ('RXCUI', 1), ('HMDB', 1), ('KEGG.COMPOUND', 1), ('MESH', 1)}) 1 frozenset({('CHEMBL.COMPOUND', 1), ('CAS', 4), ('PUBCHEM.COMPOUND', 1), ('GTOPDB', 1), ('UNII', 1), ('INCHIKEY', 1), ('HMDB', 1), ('RXCUI', 1), ('KEGG.COMPOUND', 2), ('MESH', 2), ('CHEBI', 6), ('UMLS', 2)}) 1 frozenset({('CAS', 1), ('PUBCHEM.COMPOUND', 1), ('UNII', 1), ('INCHIKEY', 1), ('DRUGBANK', 1), ('CHEBI', 6), ('KEGG.COMPOUND', 1)}) 1 frozenset({('CHEMBL.COMPOUND', 1), ('CHEBI', 5), ('CAS', 3), ('UNII', 1), ('INCHIKEY', 1), ('HMDB', 1), ('PUBCHEM.COMPOUND', 2), ('KEGG.COMPOUND', 1), ('MESH', 1)}) 1 frozenset({('PUBCHEM.COMPOUND', 1), ('CHEBI', 1), ('UNII', 1), ('CAS', 3), ('INCHIKEY', 1), ('DRUGBANK', 1), ('UMLS', 1), ('HMDB', 1), ('KEGG.COMPOUND', 1), ('MESH', 1)}) 1 frozenset({('CAS', 1), ('PUBCHEM.COMPOUND', 1), ('UNII', 1), ('INCHIKEY', 1), ('HMDB', 1), ('CHEBI', 6)}) 1 frozenset({('CHEMBL.COMPOUND', 1), ('CHEBI', 1), ('UNII', 1), ('INCHIKEY', 1), ('CAS', 5), ('PUBCHEM.COMPOUND', 2)}) 1 frozenset({('CHEMBL.COMPOUND', 1), ('PUBCHEM.COMPOUND', 1), ('UNII', 1), ('INCHIKEY', 1), ('DRUGBANK', 1), ('CHEBI', 4), ('CAS', 2), ('HMDB', 1), ('KEGG.COMPOUND', 1), ('MESH', 1)}) 1 frozenset({('CHEMBL.COMPOUND', 1), ('DRUGCENTRAL', 1), ('PUBCHEM.COMPOUND', 1), ('GTOPDB', 1), ('UNII', 1), ('UMLS', 1), ('INCHIKEY', 1), ('DRUGBANK', 1), ('RXCUI', 1), ('HMDB', 1)}) 1 frozenset({('CAS', 1), ('CHEMBL.COMPOUND', 1), ('INCHIKEY', 1), ('DRUGBANK', 1), ('PUBCHEM.COMPOUND', 3)}) 1 frozenset({('CHEBI', 2), ('DRUGCENTRAL', 1), ('PUBCHEM.COMPOUND', 1), ('CAS', 3), ('UNII', 1), ('UMLS', 1), ('INCHIKEY', 1), ('DRUGBANK', 1), ('CHEMBL.COMPOUND', 2), ('RXCUI', 1), ('HMDB', 1), ('KEGG.COMPOUND', 1), ('MESH', 1)}) 1 frozenset({('CHEBI', 2), ('PUBCHEM.COMPOUND', 1), ('UNII', 1), ('UMLS', 1), ('INCHIKEY', 1), ('DRUGBANK', 1), ('CAS', 2), ('RXCUI', 1), ('MESH', 1)}) 1 frozenset({('PUBCHEM.COMPOUND', 1), ('CHEBI', 5), ('UNII', 1), ('UMLS', 1), ('INCHIKEY', 1), ('DRUGBANK', 1), ('CAS', 2), ('MESH', 1)}) 1 frozenset({('DRUGCENTRAL', 1), ('UMLS', 2), ('RXCUI', 2), ('CHEBI', 1), ('UNII', 1), ('INCHIKEY', 1), ('DRUGBANK', 1), ('CAS', 5), ('PUBCHEM.COMPOUND', 2), ('MESH', 1)}) 1 frozenset({('CHEMBL.COMPOUND', 1), ('PUBCHEM.COMPOUND', 1), ('CAS', 3), ('UNII', 1), ('UMLS', 1), ('INCHIKEY', 1), ('DRUGBANK', 1), ('RXCUI', 1)}) 1 frozenset({('CAS', 1), ('PUBCHEM.COMPOUND', 1), ('UMLS', 1), ('INCHIKEY', 1), ('CHEBI', 6), ('MESH', 1)}) 1 frozenset({('PUBCHEM.COMPOUND', 3), ('CAS', 4), ('INCHIKEY', 1), ('HMDB', 1)}) 1 frozenset({('PUBCHEM.COMPOUND', 4), ('CHEBI', 2), ('CAS', 4), ('UNII', 1), ('UMLS', 1), ('INCHIKEY', 1), ('DRUGBANK', 1), ('RXCUI', 1), ('MESH', 1)}) 1 frozenset({('DRUGCENTRAL', 1), ('PUBCHEM.COMPOUND', 1), ('CAS', 3), ('CHEMBL.COMPOUND', 3), ('UNII', 1), ('INCHIKEY', 1), ('DRUGBANK', 1), ('UMLS', 1), ('RXCUI', 1), ('HMDB', 1), ('MESH', 1), ('KEGG.COMPOUND', 1), ('CHEBI', 9)}) 1 frozenset({('PUBCHEM.COMPOUND', 1), ('CHEBI', 1), ('UNII', 1), ('CAS', 3), ('INCHIKEY', 1), ('DRUGBANK', 1), ('UMLS', 1), ('RXCUI', 1), ('HMDB', 1), ('MESH', 1)}) 1 frozenset({('CHEMBL.COMPOUND', 1), ('PUBCHEM.COMPOUND', 1), ('GTOPDB', 1), ('UNII', 1), ('UMLS', 1), ('INCHIKEY', 1), ('DRUGBANK', 1), ('CAS', 2), ('RXCUI', 1)}) 1 frozenset({('CHEMBL.COMPOUND', 1), ('UMLS', 2), ('PUBCHEM.COMPOUND', 1), ('UNII', 1), ('INCHIKEY', 1), ('DRUGBANK', 1), ('KEGG.COMPOUND', 1), ('CAS', 2), ('RXCUI', 1), ('HMDB', 1), ('CHEBI', 3), ('MESH', 1)}) 1 frozenset({('CHEBI', 2), ('PUBCHEM.COMPOUND', 1), ('UNII', 1), ('UMLS', 1), ('INCHIKEY', 1), ('MESH', 1)}) 1 frozenset({('CHEMBL.COMPOUND', 1), ('DRUGCENTRAL', 1), ('PUBCHEM.COMPOUND', 1), ('GTOPDB', 1), ('CHEBI', 1), ('UNII', 1), ('UMLS', 1), ('INCHIKEY', 1), ('CAS', 2), ('RXCUI', 1), ('HMDB', 1), ('MESH', 1)}) 1 frozenset({('CHEMBL.COMPOUND', 1), ('DRUGCENTRAL', 1), ('PUBCHEM.COMPOUND', 1), ('CHEBI', 5), ('UNII', 1), ('CAS', 9), ('INCHIKEY', 1), ('HMDB', 1), ('KEGG.COMPOUND', 1), ('MESH', 1)}) 1 frozenset({('CHEMBL.COMPOUND', 1), ('DRUGCENTRAL', 1), ('CHEBI', 5), ('DRUGBANK', 2), ('UNII', 1), ('UMLS', 1), ('INCHIKEY', 1), ('RXCUI', 1), ('CAS', 5), ('HMDB', 1), ('PUBCHEM.COMPOUND', 2), ('KEGG.COMPOUND', 1), ('MESH', 1)}) 1 frozenset({('CAS', 4), ('DRUGCENTRAL', 1), ('UNII', 1), ('UMLS', 1), ('INCHIKEY', 1), ('CHEBI', 4), ('PUBCHEM.COMPOUND', 3), ('GTOPDB', 3), ('HMDB', 1), ('KEGG.COMPOUND', 1), ('MESH', 1)}) 1 frozenset({('CHEMBL.COMPOUND', 1), ('PUBCHEM.COMPOUND', 1), ('CHEBI', 5), ('CAS', 3), ('UMLS', 1), ('INCHIKEY', 1), ('HMDB', 1), ('KEGG.COMPOUND', 1), ('MESH', 1)}) 1 frozenset({('CAS', 1), ('PUBCHEM.COMPOUND', 1), ('UMLS', 1), ('INCHIKEY', 1), ('RXCUI', 1), ('HMDB', 1), ('CHEBI', 3), ('MESH', 1)}) 1 frozenset({('CHEBI', 1), ('UNII', 1), ('CAS', 3), ('INCHIKEY', 1), ('PUBCHEM.COMPOUND', 2)}) 1 frozenset({('CHEMBL.COMPOUND', 1), ('PUBCHEM.COMPOUND', 1), ('CAS', 3), ('UNII', 1), ('INCHIKEY', 1), ('DRUGBANK', 1), ('HMDB', 1), ('CHEBI', 6)}) 1 frozenset({('PUBCHEM.COMPOUND', 1), ('CHEBI', 1), ('UNII', 1), ('UMLS', 1), ('INCHIKEY', 1), ('DRUGBANK', 1), ('HMDB', 1), ('CAS', 2), ('RXCUI', 1), ('MESH', 2)}) 1 frozenset({('CHEMBL.COMPOUND', 1), ('CAS', 7), ('PUBCHEM.COMPOUND', 1), ('CHEBI', 5), ('GTOPDB', 1), ('UNII', 1), ('UMLS', 1), ('INCHIKEY', 1), ('DRUGBANK', 1), ('RXCUI', 1), ('HMDB', 1), ('KEGG.COMPOUND', 1), ('MESH', 1)}) 1 frozenset({('UNII', 2), ('RXCUI', 2), ('PUBCHEM.COMPOUND', 1), ('MESH', 3), ('INCHIKEY', 1), ('DRUGBANK', 1), ('CAS', 6), ('CHEMBL.COMPOUND', 2), ('DRUGCENTRAL', 2), ('HMDB', 1), ('CHEBI', 6), ('UMLS', 3), ('KEGG.COMPOUND', 1)}) 1 frozenset({('CHEBI', 8), ('INCHIKEY', 1), ('PUBCHEM.COMPOUND', 1)}) 1 frozenset({('CHEMBL.COMPOUND', 1), ('PUBCHEM.COMPOUND', 1), ('CHEBI', 5), ('GTOPDB', 1), ('CAS', 3), ('UNII', 1), ('UMLS', 1), ('INCHIKEY', 1), ('RXCUI', 1), ('HMDB', 1), ('KEGG.COMPOUND', 1), ('MESH', 1)}) 1 frozenset({('CHEMBL.COMPOUND', 1), ('PUBCHEM.COMPOUND', 1), ('CHEBI', 1), ('UNII', 1), ('INCHIKEY', 1), ('DRUGBANK', 1), ('HMDB', 1), ('CAS', 2), ('MESH', 2)}) 1 frozenset({('PUBCHEM.COMPOUND', 7), ('INCHIKEY', 1), ('HMDB', 1)}) 1 frozenset({('GTOPDB', 2), ('CHEMBL.COMPOUND', 1), ('CHEBI', 5), ('UNII', 1), ('INCHIKEY', 1), ('CAS', 5), ('HMDB', 1), ('PUBCHEM.COMPOUND', 2), ('KEGG.COMPOUND', 1)}) 1 frozenset({('GTOPDB', 2), ('PUBCHEM.COMPOUND', 3), ('INCHIKEY', 1)}) 1 frozenset({('CHEMBL.COMPOUND', 1), ('CHEBI', 2), ('PUBCHEM.COMPOUND', 1), ('GTOPDB', 1), ('CAS', 3), ('INCHIKEY', 1), ('HMDB', 1), ('MESH', 1)}) 1 frozenset({('CHEMBL.COMPOUND', 1), ('CAS', 4), ('PUBCHEM.COMPOUND', 1), ('CHEBI', 5), ('UNII', 1), ('INCHIKEY', 1), ('DRUGBANK', 1), ('HMDB', 1), ('MESH', 2), ('KEGG.COMPOUND', 1), ('UMLS', 2)}) 1 frozenset({('CHEBI', 2), ('DRUGCENTRAL', 1), ('PUBCHEM.COMPOUND', 1), ('UNII', 1), ('UMLS', 1), ('INCHIKEY', 1), ('DRUGBANK', 1), ('CAS', 2), ('MESH', 1)}) 1 frozenset({('CHEMBL.COMPOUND', 1), ('DRUGCENTRAL', 1), ('PUBCHEM.COMPOUND', 1), ('GTOPDB', 1), ('INCHIKEY', 1), ('DRUGBANK', 1), ('CAS', 2), ('HMDB', 1)}) 1 frozenset({('CHEMBL.COMPOUND', 1), ('CHEBI', 1), ('UNII', 1), ('INCHIKEY', 1), ('CAS', 2), ('HMDB', 1), ('PUBCHEM.COMPOUND', 2), ('KEGG.COMPOUND', 1)}) 1 frozenset({('PUBCHEM.COMPOUND', 1), ('CHEBI', 1), ('INCHIKEY', 1), ('CAS', 2), ('HMDB', 1), ('KEGG.COMPOUND', 1), ('MESH', 1)}) 1 frozenset({('CHEMBL.COMPOUND', 1), ('PUBCHEM.COMPOUND', 1), ('CHEBI', 1), ('UMLS', 1), ('INCHIKEY', 1), ('DRUGBANK', 1), ('RXCUI', 1), ('HMDB', 1)}) 1 frozenset({('CAS', 1), ('CHEMBL.COMPOUND', 1), ('CHEBI', 2), ('PUBCHEM.COMPOUND', 1), ('GTOPDB', 1), ('UNII', 1), ('UMLS', 1), ('INCHIKEY', 1), ('DRUGBANK', 1), ('MESH', 1)}) 1 frozenset({('CHEMBL.COMPOUND', 1), ('DRUGCENTRAL', 1), ('UNII', 1), ('UMLS', 1), ('INCHIKEY', 1), ('DRUGBANK', 1), ('KEGG.COMPOUND', 1), ('CAS', 2), ('RXCUI', 1), ('HMDB', 1), ('PUBCHEM.COMPOUND', 2), ('CHEBI', 3)}) 1 frozenset({('CAS', 1), ('DRUGCENTRAL', 1), ('PUBCHEM.COMPOUND', 1), ('UNII', 1), ('INCHIKEY', 1), ('CHEBI', 3), ('MESH', 1)}) 1 frozenset({('PUBCHEM.COMPOUND', 2), ('INCHIKEY', 1), ('CAS', 5), ('CHEMBL.COMPOUND', 1)}) 1 frozenset({('CAS', 1), ('DRUGCENTRAL', 1), ('PUBCHEM.COMPOUND', 1), ('UNII', 1), ('UMLS', 1), ('INCHIKEY', 1), ('RXCUI', 1)}) 1 frozenset({('CAS', 1), ('GTOPDB', 2), ('PUBCHEM.COMPOUND', 1), ('UNII', 1), ('INCHIKEY', 1), ('HMDB', 1)}) 1 frozenset({('UNII', 1), ('INCHIKEY', 1), ('DRUGBANK', 1), ('CAS', 2), ('PUBCHEM.COMPOUND', 2)}) 1 frozenset({('CAS', 1), ('DRUGCENTRAL', 1), ('PUBCHEM.COMPOUND', 1), ('CHEBI', 1), ('UNII', 1), ('INCHIKEY', 1), ('MESH', 2), ('UMLS', 2)}) 1 frozenset({('CAS', 1), ('CHEMBL.COMPOUND', 1), ('DRUGCENTRAL', 1), ('PUBCHEM.COMPOUND', 1), ('UNII', 1), ('UMLS', 1), ('INCHIKEY', 1), ('MESH', 1)}) 1 frozenset({('CAS', 1), ('CHEMBL.COMPOUND', 1), ('PUBCHEM.COMPOUND', 4), ('CHEBI', 1), ('INCHIKEY', 1), ('KEGG.COMPOUND', 1), ('MESH', 1)}) 1 frozenset({('CHEMBL.COMPOUND', 1), ('CHEBI', 2), ('DRUGCENTRAL', 1), ('PUBCHEM.COMPOUND', 1), ('UNII', 1), ('UMLS', 1), ('INCHIKEY', 1), ('DRUGBANK', 1), ('RXCUI', 1), ('CAS', 5), ('KEGG.COMPOUND', 1), ('MESH', 1)}) 1 frozenset({('CHEMBL.COMPOUND', 1), ('CHEBI', 2), ('PUBCHEM.COMPOUND', 1), ('UNII', 1), ('INCHIKEY', 1), ('HMDB', 1)}) 1 frozenset({('DRUGCENTRAL', 1), ('PUBCHEM.COMPOUND', 1), ('CHEBI', 1), ('UNII', 1), 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