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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02858187

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
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
DEB6-DEOXYERYTHRONOLIDE BA1Z8P0.76
DEB6-DEOXYERYTHRONOLIDE BA1JIO0.76
DEB6-DEOXYERYTHRONOLIDE BA1Z8Q0.76
DEB6-DEOXYERYTHRONOLIDE BA1OXA0.76
DEB6-DEOXYERYTHRONOLIDE BA1Z8O0.76
B3H(2S)-2-(BUTYRYLOXY)-3-HYDROXYPROPYL NONANOATEC,D2HFE0.73
B3H(2S)-2-(BUTYRYLOXY)-3-HYDROXYPROPYL NONANOATEC,D2H8P0.73
B3H(2S)-2-(BUTYRYLOXY)-3-HYDROXYPROPYL NONANOATEC,D2HG50.73
F24(3R,5S,7R,12S,13R)-13-FORMYL-12,14-
DIHYDROXY-3,5,7-TRIMETHYLTETRADECANOIC ACID
A2F9A0.76
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
IPM3-ISOPROPYLMALIC ACIDA,B1A050.7
IPM3-ISOPROPYLMALIC ACIDA1HJ60.7
LIL2-TRIDECANOYLOXY-PENTADECANOIC ACIDA2FCP0.78
LIL2-TRIDECANOYLOXY-PENTADECANOIC ACIDA1FCP0.78
GVM(3R)-3-HYDROXY-5,5-DIMETHYLHEXANOIC ACIDA,B2UW10.84
LMLISOBUTYL MALONIC ACIDA1BFW0.75
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
MEV(R)-MEVALONATEA,B1QAY0.71
MEV(R)-MEVALONATEA2HFU0.71
MEV(R)-MEVALONATEA,B1R310.71
HXD(3R)-3-HYDROXYDODECANOIC ACIDA2DDH0.77
RB3(1R)-3-{[(1R)-3-METHOXY-1-METHYL-
3-OXOPROPYL]OXY}-1-METHYL-3-OXOPROPYL (3R)-
3-HYDROXYBUTANOATE
A2D810.77
HHG(2R)-2-HYDROXY-3-(PHOSPHONOOXY)PROPYL HEXANOATEA1Y9T0.7
HHG(2R)-2-HYDROXY-3-(PHOSPHONOOXY)PROPYL HEXANOATEA,B3E3C0.7
DMV2,3-DIHYDROXY-VALERIANIC ACIDA,B,C,D1QMG0.7
FTT3-HYDROXY-TETRADECANOIC ACIDA1QFF0.77
FTT3-HYDROXY-TETRADECANOIC ACIDA1QJQ0.77
FTT3-HYDROXY-TETRADECANOIC ACIDA,B2GRX0.77
FTT3-HYDROXY-TETRADECANOIC ACIDA1QFG0.77
FTT3-HYDROXY-TETRADECANOIC ACIDA1QKC0.77
FTT3-HYDROXY-TETRADECANOIC ACIDA1FI10.77
FTT3-HYDROXY-TETRADECANOIC ACIDA,B,C,D3FXI0.77