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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02147697

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
SHO5-HYDROXYLAEVULINIC ACIDA1W310.7
3OH3-HYDROXY-PROPANOIC ACIDA1M330.78
3HL(3S)-3-HYDROXYBUTANOIC ACIDA2ECQ1
3HL(3S)-3-HYDROXYBUTANOIC ACIDA,B,C,D3EEW1
MEV(R)-MEVALONATEA,B1QAY0.74
MEV(R)-MEVALONATEA2HFU0.74
MEV(R)-MEVALONATEA,B1R310.74
BU21,3-BUTANEDIOLA,B1LOL0.72
BU21,3-BUTANEDIOLA,B2RFM0.72
3PY3-HYDROXYPYRUVIC ACIDA,B,C,D1HL20.72
3PY3-HYDROXYPYRUVIC ACIDA,B1O5X0.72
3PY3-HYDROXYPYRUVIC ACIDA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P
1NFV0.72
3PY3-HYDROXYPYRUVIC ACIDA,B,C,D1FDY0.72
DTHD-THREONINEA1KRO0.71
DTHD-THREONINEA,B,C,D3BOG0.71
DTHD-THREONINEA,B173D0.71
DTHD-THREONINEA209D0.71
DTHD-THREONINEA316D0.71
DTHD-THREONINEA,B2Q330.71
DTHD-THREONINEA2JUE0.71
DTHD-THREONINEA2D550.71
THETHREONATE IONA1XIJ0.77
SRTS,R MESO-TARTARIC ACIDA,B1N970.75
SRTS,R MESO-TARTARIC ACIDA,B2V6Y0.75
SRTS,R MESO-TARTARIC ACIDA2OT90.75
SRTS,R MESO-TARTARIC ACIDA2R610.75
SRTS,R MESO-TARTARIC ACIDA1XXN0.75
SRTS,R MESO-TARTARIC ACIDA,B2IXI0.75
SRTS,R MESO-TARTARIC ACIDA2RA50.75
SRTS,R MESO-TARTARIC ACIDA,B2C1L0.75
SRTS,R MESO-TARTARIC ACIDA2IXJ0.75
SRTS,R MESO-TARTARIC ACIDA,B,C,D,E,F,
G,H,I,J,K,L
2JBM0.75
SRTS,R MESO-TARTARIC ACIDA3CMJ0.75
SRTS,R MESO-TARTARIC ACIDA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P
2DW70.75
SRTS,R MESO-TARTARIC ACIDB,C,D2P3V0.75
SRTS,R MESO-TARTARIC ACIDA3CK20.75
SRTS,R MESO-TARTARIC ACIDA1RTV0.75
SRTS,R MESO-TARTARIC ACIDA,B,C3H350.75
SRTS,R MESO-TARTARIC ACIDA2RKU0.75
TLAL(+)-TARTARIC ACIDA,B,C1NXJ0.75
TLAL(+)-TARTARIC ACIDX3BIA0.75
TLAL(+)-TARTARIC ACIDA2CX10.75
TLAL(+)-TARTARIC ACIDA2CVE0.75
TLAL(+)-TARTARIC ACIDA2Q9H0.75
TLAL(+)-TARTARIC ACIDA,B1FS50.75
TLAL(+)-TARTARIC ACIDA,B,C,D2V9G0.75
TLAL(+)-TARTARIC ACIDA,B2Q5Q0.75
TLAL(+)-TARTARIC ACIDA,B,C,D,E,F,
G,H
3D460.75
TLAL(+)-TARTARIC ACIDX2A7I0.75
TLAL(+)-TARTARIC ACIDA2RCT0.75
TLAL(+)-TARTARIC ACIDA,B1V840.75
TLAL(+)-TARTARIC ACIDC,E,F,I,L2DXC0.75
TLAL(+)-TARTARIC ACIDA2PE70.75
TLAL(+)-TARTARIC ACIDA2JFW0.75
TLAL(+)-TARTARIC ACIDA1U7L0.75
TLAL(+)-TARTARIC ACIDA,B1VEC0.75
TLAL(+)-TARTARIC ACIDA,B,C,D3C2X0.75
TLAL(+)-TARTARIC ACIDA1Q1K0.75
TLAL(+)-TARTARIC ACIDA1VPD0.75
TLAL(+)-TARTARIC ACIDB1SMO0.75
TLAL(+)-TARTARIC ACIDA2DBP0.75
TLAL(+)-TARTARIC ACIDA1D5R0.75
TLAL(+)-TARTARIC ACIDA,B1SQS0.75
TLAL(+)-TARTARIC ACIDA2BLR0.75
TLAL(+)-TARTARIC ACIDA,B,C,D2DW60.75
TLAL(+)-TARTARIC ACIDA2GPT0.75
TLAL(+)-TARTARIC ACIDA,B,C,D,E,F,
G,H
3HZN0.75
TLAL(+)-TARTARIC ACIDA,B2D6Y0.75
TLAL(+)-TARTARIC ACIDA2O7S0.75
TLAL(+)-TARTARIC ACIDA,B3DC20.75
TLAL(+)-TARTARIC ACIDA,B,C,D3EZ00.75
TLAL(+)-TARTARIC ACIDA1LXZ0.75
TLAL(+)-TARTARIC ACIDA3E0A0.75
TLAL(+)-TARTARIC ACIDA3G0O0.75
TLAL(+)-TARTARIC ACIDA,B2O4C0.75
TLAL(+)-TARTARIC ACIDA1EKS0.75
TLAL(+)-TARTARIC ACIDA,B,C,D,E,F,
G,H,I,J,K,L
1GU10.75
TLAL(+)-TARTARIC ACIDA,B3EKG0.75
TLAL(+)-TARTARIC ACIDA,B2Z8O0.75
TLAL(+)-TARTARIC ACIDA2GLA0.75
TLAL(+)-TARTARIC ACIDA,B2QT60.75
TLAL(+)-TARTARIC ACIDA3DZR0.75
TLAL(+)-TARTARIC ACIDA,B,C,D,E,F,
G,H,I,J,K,L
3CIQ0.75
TLAL(+)-TARTARIC ACIDA,C2EGZ0.75
TLAL(+)-TARTARIC ACIDA,B,C3C930.75
TLAL(+)-TARTARIC ACIDA2B200.75
TLAL(+)-TARTARIC ACIDA2RCQ0.75
TLAL(+)-TARTARIC ACIDA,B,C3CXA0.75
TLAL(+)-TARTARIC ACIDA1LR30.75
TLAL(+)-TARTARIC ACIDA1VBW0.75
TLAL(+)-TARTARIC ACIDA,B2H0V0.75
TLAL(+)-TARTARIC ACIDA,B,C,D2QJW0.75
TLAL(+)-TARTARIC ACIDA1D6J0.75
TLAL(+)-TARTARIC ACIDA3DZP0.75
TLAL(+)-TARTARIC ACIDA1LY00.75
TLAL(+)-TARTARIC ACIDA,B3DDN0.75
TLAL(+)-TARTARIC ACIDA3E3S0.75
TLAL(+)-TARTARIC ACIDA,B,C,D,E,F,
G,H
1S200.75
TLAL(+)-TARTARIC ACIDA2VI40.75
TLAL(+)-TARTARIC ACIDA1OHT0.75
TLAL(+)-TARTARIC ACIDA,B,C,D3GQY0.75
TLAL(+)-TARTARIC ACIDA,B3H6G0.75
TLAL(+)-TARTARIC ACIDA,B,C,D1XPJ0.75
TLAL(+)-TARTARIC ACIDA,B,C,D1EI60.75
TLAL(+)-TARTARIC ACIDA,B2B130.75
TLAL(+)-TARTARIC ACIDA3EKE0.75
TLAL(+)-TARTARIC ACIDA,B1ZL00.75
TLAL(+)-TARTARIC ACIDA,B,C,D2R2K0.75
TLAL(+)-TARTARIC ACIDA,B,C3CG90.75
TLAL(+)-TARTARIC ACIDA,B,C,D3GR40.75
TLAL(+)-TARTARIC ACIDA2RKU0.75
TLAL(+)-TARTARIC ACIDA2VI30.75
TLAL(+)-TARTARIC ACIDA,B1V830.75
TLAL(+)-TARTARIC ACIDA2WBO0.75
TLAL(+)-TARTARIC ACIDA,B2PYX0.75
TLAL(+)-TARTARIC ACIDA2VHR0.75
TLAL(+)-TARTARIC ACIDA1ALU0.75
TLAL(+)-TARTARIC ACIDA1LR20.75
TLAL(+)-TARTARIC ACIDA3DZN0.75
TLAL(+)-TARTARIC ACIDA,B,C,D1WQS0.75
TLAL(+)-TARTARIC ACIDA,B,C,D2UYV0.75
TLAL(+)-TARTARIC ACIDA1J2Z0.75
TLAL(+)-TARTARIC ACIDA,B3DME0.75
TLAL(+)-TARTARIC ACIDX1K2Y0.75
TLAL(+)-TARTARIC ACIDA1RQW0.75
TLAL(+)-TARTARIC ACIDA2BLU0.75
TLAL(+)-TARTARIC ACIDA,B2C1L0.75
TLAL(+)-TARTARIC ACIDA,B,C,D,E,F,
G,H,I,J
2C910.75
TLAL(+)-TARTARIC ACIDA,B,C3COR0.75
TLAL(+)-TARTARIC ACIDA2FX50.75
TLAL(+)-TARTARIC ACIDA1THW0.75
TLAL(+)-TARTARIC ACIDA2CZL0.75
TLAL(+)-TARTARIC ACIDA2VHK0.75
TLAL(+)-TARTARIC ACIDA1H3D0.75
TLAL(+)-TARTARIC ACIDA,B,C2Z9N0.75
TLAL(+)-TARTARIC ACIDA1V820.75
LMR(2S)-2-hydroxybutanedioic acidA3CSC0.75
LMR(2S)-2-hydroxybutanedioic acidA,B2W980.75
LMR(2S)-2-hydroxybutanedioic acidA1CSC0.75
LMR(2S)-2-hydroxybutanedioic acidA,B3ES70.75
LMR(2S)-2-hydroxybutanedioic acidA,B,C,D,E,F,
G,H
3ES80.75
BUABUTANOIC ACIDA2CZ00.75
BUABUTANOIC ACIDA1P0I0.75
BUABUTANOIC ACIDA,B2HA70.75
BUABUTANOIC ACIDA1UK70.75
BUABUTANOIC ACIDA2J4C0.75
BUABUTANOIC ACIDA1ZRM0.75
BUABUTANOIC ACIDA3DLT0.75
BUABUTANOIC ACIDA1UGP0.75
BUABUTANOIC ACIDA,B2CZ10.75
VADDEAMINOHYDROXYVALINEC1CWO0.74
HIU(2R)-3-HYDROXY-2-METHYLPROPANOIC ACIDA3BPT0.82
HXD(3R)-3-HYDROXYDODECANOIC ACIDA2DDH0.73
TARD(-)-TARTARIC ACIDA,B2QKH0.75
TARD(-)-TARTARIC ACIDA2G4Y0.75
TARD(-)-TARTARIC ACIDA,B2Z3N0.75
TARD(-)-TARTARIC ACIDA,B,C,D2DW60.75
TARD(-)-TARTARIC ACIDA,B3CIC0.75
TARD(-)-TARTARIC ACIDA2VI20.75
TARD(-)-TARTARIC ACIDA,B2Z3O0.75
TARD(-)-TARTARIC ACIDA1KWN0.75
TARD(-)-TARTARIC ACIDA1RPA0.75
TARD(-)-TARTARIC ACIDA,B2DPT0.75
TARD(-)-TARTARIC ACIDA,B2EUA0.75
TARD(-)-TARTARIC ACIDA,B2QMF0.75
TARD(-)-TARTARIC ACIDA,B,C,D1JZ80.75
TARD(-)-TARTARIC ACIDA,B2QP80.75
TARD(-)-TARTARIC ACIDA1MZE0.75
TARD(-)-TARTARIC ACIDA,B,C,D3D4O0.75
TARD(-)-TARTARIC ACIDB,C,F,H,I,K,L2DD40.75
TARD(-)-TARTARIC ACIDA1EM20.75
TARD(-)-TARTARIC ACIDA,B3CID0.75
TARD(-)-TARTARIC ACIDA,B,C,D1CCW0.75
TARD(-)-TARTARIC ACIDA,B2Z3M0.75
TARD(-)-TARTARIC ACIDA,B2C1L0.75
TARD(-)-TARTARIC ACIDA,B,C,E2DCY0.75
TARD(-)-TARTARIC ACIDA,B,C,D2IHU0.75
TARD(-)-TARTARIC ACIDA,B2QMG0.75
TARD(-)-TARTARIC ACIDC1HVV0.75
TARD(-)-TARTARIC ACIDA,B2QMD0.75
TARD(-)-TARTARIC ACIDA,B2Z3K0.75
TARD(-)-TARTARIC ACIDA,B2Z3P0.75
TARD(-)-TARTARIC ACIDA,B3CIB0.75
TARD(-)-TARTARIC ACIDA,B2Z3L0.75
TARD(-)-TARTARIC ACIDA,B2FP90.75
TARD(-)-TARTARIC ACIDA,B2CDQ0.75
TARD(-)-TARTARIC ACIDA2HUB0.75
TARD(-)-TARTARIC ACIDA2OQN0.75
TARD(-)-TARTARIC ACIDA,B,C,D1CB70.75
TARD(-)-TARTARIC ACIDA2RKU0.75
TARD(-)-TARTARIC ACIDA,B3D420.75
TARD(-)-TARTARIC ACIDA,B2ZYQ0.75
TARD(-)-TARTARIC ACIDA,B1YGY0.75
TARD(-)-TARTARIC ACIDA,B,C,D1WQS0.75
AAEACETOACETIC ACIDA,B,C,D3EEW0.76
AAEACETOACETIC ACIDA1FCP0.76
AAEACETOACETIC ACIDA1UJW0.76
AAEACETOACETIC ACIDA,B1QCO0.76
AAEACETOACETIC ACIDA,B,C,D,L1E3W0.76
AAEACETOACETIC ACIDA,B1YSL0.76
AAEACETOACETIC ACIDA2FCP0.76
DGY(2R)-2,3-DIHYDROXYPROPANOIC ACIDA,B,C,D2GCG0.73
DGY(2R)-2,3-DIHYDROXYPROPANOIC ACIDA,B2BO60.73
FTT3-HYDROXY-TETRADECANOIC ACIDA1QFF0.73
FTT3-HYDROXY-TETRADECANOIC ACIDA1QJQ0.73
FTT3-HYDROXY-TETRADECANOIC ACIDA,B2GRX0.73
FTT3-HYDROXY-TETRADECANOIC ACIDA1QFG0.73
FTT3-HYDROXY-TETRADECANOIC ACIDA1QKC0.73
FTT3-HYDROXY-TETRADECANOIC ACIDA1FI10.73
FTT3-HYDROXY-TETRADECANOIC ACIDA,B,C,D3FXI0.73
DMV2,3-DIHYDROXY-VALERIANIC ACIDA,B,C,D1QMG0.73
3PB(3R)-3-(phosphonooxy)butanoic acidA,B,C,D,E,F3FG80.79
KPLKETOPANTOATEA,B,C,D,E,F,
G,H,I,J
1M3U0.71
3HG3-HYDROXYPENTANEDIOIC ACIDA,B,C,D,E,F2CW60.79
BUQ4-HYDROXY-2-BUTANONEA,B1D7J0.79
RB3(1R)-3-{[(1R)-3-METHOXY-1-METHYL-
3-OXOPROPYL]OXY}-1-METHYL-3-OXOPROPYL (3R)-
3-HYDROXYBUTANOATE
A2D810.86
DMR2-HYDROXY-SUCCINIC ACIDA,B2YZO0.75
DMR2-HYDROXY-SUCCINIC ACIDA4CSC0.75
DMR2-HYDROXY-SUCCINIC ACIDH,L1C1E0.75
DMR2-HYDROXY-SUCCINIC ACIDA2CSC0.75
DMR2-HYDROXY-SUCCINIC ACIDA2AR90.75
MLTMALATE IONA1WZU0.75
MLTMALATE IONA,B3G1P0.75
MLTMALATE IONA,B1KQ70.75
MLTMALATE IONA3BI80.75
MLTMALATE IONA,B2GQ30.75
MLTMALATE IONA2VKL0.75
MLTMALATE IONA1AMZ0.75
MLTMALATE IONA3B7O0.75
MLTMALATE IONA,B,C,D2DFD0.75
MLTMALATE IONA,B2Z1Z0.75
MLTMALATE IONA,B1N8W0.75
MLTMALATE IONA,B,C,D1PJ40.75
MLTMALATE IONA,B1FUO0.75
MLTMALATE IONA,B,C,D1OUW0.75
MLTMALATE IONA2BYO0.75
MLTMALATE IONA,B2G760.75
MLTMALATE IONX2FGQ0.75
MLTMALATE IONB2VJ20.75
MLTMALATE IONA1XUU0.75
MLTMALATE IONA,B1FUP0.75
MLTMALATE IONA,B,C,D,E,F,
G,H
3D470.75
MLTMALATE IONA,B,C,D1NBE0.75
MLTMALATE IONA2IMG0.75
MLTMALATE IONA3CM40.75
MLTMALATE IONA3BY80.75
MLTMALATE IONA,B,C,D1WWJ0.75
MLTMALATE IONA,B1FUR0.75
MLTMALATE IONA,B,C,D1PJ20.75
MLTMALATE IONA3DR30.75
ALOALLO-THREONINEI,P1HDT0.71
ALOALLO-THREONINEA2JUU0.71
ALOALLO-THREONINEA2VMX0.71