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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02812912

You can sort the columns by Ligand, Ligand name, PDB and Tanimoto.


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
SHO5-HYDROXYLAEVULINIC ACIDA1W311
GUAGLUTARIC ACIDA,B1JW00.85
GUAGLUTARIC ACIDA,B,C,D1B4N0.85
GUAGLUTARIC ACIDA1AMS0.85
GUAGLUTARIC ACIDA,B1XEY0.85
GUAGLUTARIC ACIDA1CZC0.85
GUAGLUTARIC ACIDA,B,C1IYD0.85
GAQ5-HYDROXYPENTANALA,B1ZLP0.82
3HG3-HYDROXYPENTANEDIOIC ACIDA,B,C,D,E,F2CW60.82
LEALEVULINIC ACIDP1VWR0.81
LEALEVULINIC ACIDM,P1VWJ0.81
LEALEVULINIC ACIDA,B1W1Z0.81
LEALEVULINIC ACIDA,B1B4K0.81
LEALEVULINIC ACIDM,P1VWK0.81
LEALEVULINIC ACIDP1VWQ0.81
LEALEVULINIC ACIDA1UK80.81
LEALEVULINIC ACIDM,P1VWL0.81
LEALEVULINIC ACIDM,P1VWI0.81
LEALEVULINIC ACIDA1B4E0.81
MEV(R)-MEVALONATEA,B1QAY0.76
MEV(R)-MEVALONATEA2HFU0.76
MEV(R)-MEVALONATEA,B1R310.76
6NAHEXANOIC ACIDA,B2IX40.74
6NAHEXANOIC ACIDA,B2IWZ0.74
6NAHEXANOIC ACIDA2IQ00.74
12H12-HYDROXYDODECANOIC ACIDA,B1M6W0.73
4MV4-METHYL VALERIC ACIDA,B,C1I1M0.72
4MV4-METHYL VALERIC ACIDA,B,C2EIY0.72
4MV4-METHYL VALERIC ACIDA2ECO0.72
4MV4-METHYL VALERIC ACIDA,C,D1UMC0.72
4MV4-METHYL VALERIC ACIDA,B2COG0.72
SHFLAEVULINIC ACIDA1YLV0.72
SHFLAEVULINIC ACIDA1H7N0.72
HKV4,5-DIOXOPENTANOIC ACIDA2JB80.72
BUABUTANOIC ACIDA2CZ00.72
BUABUTANOIC ACIDA1P0I0.72
BUABUTANOIC ACIDA,B2HA70.72
BUABUTANOIC ACIDA1UK70.72
BUABUTANOIC ACIDA2J4C0.72
BUABUTANOIC ACIDA1ZRM0.72
BUABUTANOIC ACIDA3DLT0.72
BUABUTANOIC ACIDA1UGP0.72
BUABUTANOIC ACIDA,B2CZ10.72
3HL(3S)-3-HYDROXYBUTANOIC ACIDA2ECQ0.7
3HL(3S)-3-HYDROXYBUTANOIC ACIDA,B,C,D3EEW0.7
TRCTRICARBALLYLIC ACIDA6ACN0.7
TRCTRICARBALLYLIC ACIDA,B2PW00.7
TRCTRICARBALLYLIC ACIDA5ACN0.7
DO42,5-DIOXOPENTANOIC ACIDX2Q1D0.7