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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03375573

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
4MV4-METHYL VALERIC ACIDA,B,C1I1M0.77
4MV4-METHYL VALERIC ACIDA,B,C2EIY0.77
4MV4-METHYL VALERIC ACIDA2ECO0.77
4MV4-METHYL VALERIC ACIDA,C,D1UMC0.77
4MV4-METHYL VALERIC ACIDA,B2COG0.77
3PA3-CYCLOPENTYL-PROPIONIC ACIDC1FAV0.8
0PAcyclopentylacetic acidA,B3DWR0.83
GVM(3R)-3-HYDROXY-5,5-DIMETHYLHEXANOIC ACIDA,B2UW10.71
6NAHEXANOIC ACIDA,B2IX40.79
6NAHEXANOIC ACIDA,B2IWZ0.79
6NAHEXANOIC ACIDA2IQ00.79
2PP2-PROPYL-PENTANOIC ACIDP1DIT0.76
AC51-AMINOCYCLOPENTANECARBOXYLIC ACIDA,B1Y1M0.7
CCM1-METHYL-1-CARBOXY-CYCLOPENTANEA1THL1
HCT(2R)-butane-1,2,4-tricarboxylic acidA,B,C3DP80.72
HCT(2R)-butane-1,2,4-tricarboxylic acidA,B,C3E3K0.72
CXPCYCLOHEXANE PROPIONIC ACIDA,B2AY20.7
DTGDES-AMINO T-BUTYL GLYCINEA,B,C,D2WPO0.74
LNG12-METHYLTRIDECANOIC ACIDA,B,C,D,E,F,
G,H,I,J,K,L
1W3M0.72
LEALEVULINIC ACIDP1VWR0.71
LEALEVULINIC ACIDM,P1VWJ0.71
LEALEVULINIC ACIDA,B1W1Z0.71
LEALEVULINIC ACIDA,B1B4K0.71
LEALEVULINIC ACIDM,P1VWK0.71
LEALEVULINIC ACIDP1VWQ0.71
LEALEVULINIC ACIDA1UK80.71
LEALEVULINIC ACIDM,P1VWL0.71
LEALEVULINIC ACIDM,P1VWI0.71
LEALEVULINIC ACIDA1B4E0.71
SHVHEPTANOIC ACIDA1PO80.73