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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02385915

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
12H12-HYDROXYDODECANOIC ACIDA,B1M6W0.72
B3H(2S)-2-(BUTYRYLOXY)-3-HYDROXYPROPYL NONANOATEC,D2HFE0.74
B3H(2S)-2-(BUTYRYLOXY)-3-HYDROXYPROPYL NONANOATEC,D2H8P0.74
B3H(2S)-2-(BUTYRYLOXY)-3-HYDROXYPROPYL NONANOATEC,D2HG50.74
L2C(2S)-3-HYDROXY-2-(NONANOYLOXY)PROPYL LAURATEA,C2HVK0.72
L2C(2S)-3-HYDROXY-2-(NONANOYLOXY)PROPYL LAURATEA,C2DWD0.72
L2C(2S)-3-HYDROXY-2-(NONANOYLOXY)PROPYL LAURATEC2DWE0.72
L2C(2S)-3-HYDROXY-2-(NONANOYLOXY)PROPYL LAURATEA,C2HVJ0.72
EOD11-[(2R,3S)-3-PENTYLOXIRAN-2-YL]UNDECANOIC ACIDA,B,C2DIO0.75
1N5(2R,4S)-2,4,7-trihydroxyheptanoic acidA,B3CXO0.8
FTT3-HYDROXY-TETRADECANOIC ACIDA1QFF0.71
FTT3-HYDROXY-TETRADECANOIC ACIDA1QJQ0.71
FTT3-HYDROXY-TETRADECANOIC ACIDA,B2GRX0.71
FTT3-HYDROXY-TETRADECANOIC ACIDA1QFG0.71
FTT3-HYDROXY-TETRADECANOIC ACIDA1QKC0.71
FTT3-HYDROXY-TETRADECANOIC ACIDA1FI10.71
FTT3-HYDROXY-TETRADECANOIC ACIDA,B,C,D3FXI0.71
DGADIACYL GLYCEROLA,C2NLJ0.71
DGADIACYL GLYCEROLA,C1ZWI0.71
DGADIACYL GLYCEROLB,C1R3J0.71
DGADIACYL GLYCEROLC1K4D0.71
DGADIACYL GLYCEROLA,C1K4C0.71
DGADIACYL GLYCEROLC1R3K0.71
DGADIACYL GLYCEROLB,C1S5H0.71
DGADIACYL GLYCEROLC,H1R3I0.71
DGADIACYL GLYCEROLB,C1R3L0.71
HXD(3R)-3-HYDROXYDODECANOIC ACIDA2DDH0.71
VZZ11-[(MERCAPTOCARBONYL)OXY]UNDECANOIC ACIDA,B2QO10.73
DECSEBACIC ACIDA,B,C,D1CLS0.72
PMLPIMELIC ACIDA1KGT0.77
DSB4,7-DIOXOSEBACIC ACIDA,B1I8J0.74
DSB4,7-DIOXOSEBACIC ACIDA1EB30.74
DSB4,7-DIOXOSEBACIC ACIDA,B1L6S0.74
DSB4,7-DIOXOSEBACIC ACIDA,B2C1H0.74
SHU4,6-DIOXOHEPTANOIC ACIDA1H7R0.74
LIL2-TRIDECANOYLOXY-PENTADECANOIC ACIDA2FCP0.75
LIL2-TRIDECANOYLOXY-PENTADECANOIC ACIDA1FCP0.75
DDR(2S)-3-hydroxypropane-1,2-diyl didecanoateA2Z9Y0.72
DDR(2S)-3-hydroxypropane-1,2-diyl didecanoateA2Z9Z0.72
1EM(1S)-2-HYDROXY-1-[(NONANOYLOXY)METHYL]ETHYL MYRISTATEC2IH10.72
1EM(1S)-2-HYDROXY-1-[(NONANOYLOXY)METHYL]ETHYL MYRISTATEC2IH30.72
1EM(1S)-2-HYDROXY-1-[(NONANOYLOXY)METHYL]ETHYL MYRISTATEA,C2P7T0.72
AZ1AZELAIC ACIDA,B1TUF0.72
4OX4-OXODECANEDIOIC ACIDA,B1L6Y0.73
4OX4-OXODECANEDIOIC ACIDA1GJP0.73
KDF3-deoxy-alpha-D-erythro-hex-2-ulofuranosonic acidA,B,C2VAR0.7
SHVHEPTANOIC ACIDA1PO80.73