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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02147687

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
LMR(2S)-2-hydroxybutanedioic acidA3CSC0.77
LMR(2S)-2-hydroxybutanedioic acidA,B2W980.77
LMR(2S)-2-hydroxybutanedioic acidA1CSC0.77
LMR(2S)-2-hydroxybutanedioic acidA,B3ES70.77
LMR(2S)-2-hydroxybutanedioic acidA,B,C,D,E,F,
G,H		3ES80.77
3HG3-HYDROXYPENTANEDIOIC ACIDA,B,C,D,E,F2CW60.77
3HL(3S)-3-HYDROXYBUTANOIC ACIDA2ECQ0.97
3HL(3S)-3-HYDROXYBUTANOIC ACIDA,B,C,D3EEW0.97
3PB(3R)-3-(phosphonooxy)butanoic acidA,B,C,D,E,F3FG80.77
2OP(2S)-2-HYDROXYPROPANOIC ACIDA,B,C,D2VK80.71
2OP(2S)-2-HYDROXYPROPANOIC ACID0,1,3,4,9,A,
B,C,H,J,K,L,
M,N,O,Q,R,S,
T,U,Y,Z		1VQ70.71
2OP(2S)-2-HYDROXYPROPANOIC ACID0,1,3,4,9,A,
B,C,H,J,K,L,
M,N,O,Q,R,S,
T,U,Y,Z		1VQ40.71
2OP(2S)-2-HYDROXYPROPANOIC ACIDA,C,E2VOJ0.71
2OP(2S)-2-HYDROXYPROPANOIC ACID0,1,2,3,4,9,
A,B,C,H,J,K,
L,M,N,O,Q,R,
S,T,U,Y,Z		1VQ50.71
2OP(2S)-2-HYDROXYPROPANOIC ACIDA1W9N0.71
3PY3-HYDROXYPYRUVIC ACIDA,B,C,D1HL20.74
3PY3-HYDROXYPYRUVIC ACIDA,B1O5X0.74
3PY3-HYDROXYPYRUVIC ACIDA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P		1NFV0.74
3PY3-HYDROXYPYRUVIC ACIDA,B,C,D1FDY0.74
DGY(2R)-2,3-DIHYDROXYPROPANOIC ACIDA,B,C,D2GCG0.75
DGY(2R)-2,3-DIHYDROXYPROPANOIC ACIDA,B2BO60.75
3OH3-HYDROXY-PROPANOIC ACIDA1M330.81
MLTMALATE IONA1WZU0.77
MLTMALATE IONA,B3G1P0.77
MLTMALATE IONA,B1KQ70.77
MLTMALATE IONA3BI80.77
MLTMALATE IONA,B2GQ30.77
MLTMALATE IONA2VKL0.77
MLTMALATE IONA1AMZ0.77
MLTMALATE IONA3B7O0.77
MLTMALATE IONA,B,C,D2DFD0.77
MLTMALATE IONA,B2Z1Z0.77
MLTMALATE IONA,B1N8W0.77
MLTMALATE IONA,B,C,D1PJ40.77
MLTMALATE IONA,B1FUO0.77
MLTMALATE IONA,B,C,D1OUW0.77
MLTMALATE IONA2BYO0.77
MLTMALATE IONA,B2G760.77
MLTMALATE IONX2FGQ0.77
MLTMALATE IONB2VJ20.77
MLTMALATE IONA1XUU0.77
MLTMALATE IONA,B1FUP0.77
MLTMALATE IONA,B,C,D,E,F,
G,H		3D470.77
MLTMALATE IONA,B,C,D1NBE0.77
MLTMALATE IONA2IMG0.77
MLTMALATE IONA3CM40.77
MLTMALATE IONA3BY80.77
MLTMALATE IONA,B,C,D1WWJ0.77
MLTMALATE IONA,B1FUR0.77
MLTMALATE IONA,B,C,D1PJ20.77
MLTMALATE IONA3DR30.77
DMR2-HYDROXY-SUCCINIC ACIDA,B2YZO0.77
DMR2-HYDROXY-SUCCINIC ACIDA4CSC0.77
DMR2-HYDROXY-SUCCINIC ACIDH,L1C1E0.77
DMR2-HYDROXY-SUCCINIC ACIDA2CSC0.77
DMR2-HYDROXY-SUCCINIC ACIDA2AR90.77
AAEACETOACETIC ACIDA,B,C,D3EEW0.79
AAEACETOACETIC ACIDA1FCP0.79
AAEACETOACETIC ACIDA1UJW0.79
AAEACETOACETIC ACIDA,B1QCO0.79
AAEACETOACETIC ACIDA,B,C,D,L1E3W0.79
AAEACETOACETIC ACIDA,B1YSL0.79
AAEACETOACETIC ACIDA2FCP0.79
FTT3-HYDROXY-TETRADECANOIC ACIDA1QFF0.7
FTT3-HYDROXY-TETRADECANOIC ACIDA1QJQ0.7
FTT3-HYDROXY-TETRADECANOIC ACIDA,B2GRX0.7
FTT3-HYDROXY-TETRADECANOIC ACIDA1QFG0.7
FTT3-HYDROXY-TETRADECANOIC ACIDA1QKC0.7
FTT3-HYDROXY-TETRADECANOIC ACIDA1FI10.7
FTT3-HYDROXY-TETRADECANOIC ACIDA,B,C,D3FXI0.7
HIU(2R)-3-HYDROXY-2-METHYLPROPANOIC ACIDA3BPT0.79
LACLACTIC ACIDA2FLT0.71
LACLACTIC ACIDA2IMP0.71
LACLACTIC ACIDA1C0Q0.71
LACLACTIC ACIDE,I,P1P110.71
LACLACTIC ACIDA,B2NLI0.71
LACLACTIC ACIDA,B,C,D2PI10.71
LACLACTIC ACIDA1C0R0.71
LACLACTIC ACIDA1UHD0.71
LACLACTIC ACIDC,D1AXD0.71
LACLACTIC ACIDA1QH90.71
LACLACTIC ACIDA2P1E0.71
LACLACTIC ACIDA1K870.71
LACLACTIC ACIDE,I1P120.71
LACLACTIC ACIDA1W3Q0.71
LACLACTIC ACIDA1C0K0.71
LACLACTIC ACIDA,B2FN70.71
LACLACTIC ACIDA1TJ10.71
LACLACTIC ACIDA1TJ00.71
MEV(R)-MEVALONATEA,B1QAY0.71
MEV(R)-MEVALONATEA2HFU0.71
MEV(R)-MEVALONATEA,B1R310.71
HXD(3R)-3-HYDROXYDODECANOIC ACIDA2DDH0.7
2KT2-KETOBUTYRIC ACIDA1RR20.71
2KT2-KETOBUTYRIC ACIDA,B,C2UYN0.71
2KT2-KETOBUTYRIC ACIDA,B,C,D1TZK0.71
2KT2-KETOBUTYRIC ACIDX2Q1C0.71
2KT2-KETOBUTYRIC ACIDX2Q1A0.71
BUQ4-HYDROXY-2-BUTANONEA,B1D7J0.76
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
DMV2,3-DIHYDROXY-VALERIANIC ACIDA,B,C,D1QMG0.7