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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03032949

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
IDRL-IDURONIC ACIDA2V380.81
IDRL-IDURONIC ACIDA1HM20.81
IDRL-IDURONIC ACIDA2ERM0.81
MAVD-MANNURONIC ACIDA,B1J1N0.81
MAVD-MANNURONIC ACIDA1Y3P0.81
MAVD-MANNURONIC ACIDA,B,D2PYH0.81
MAVD-MANNURONIC ACIDA1Y3N0.81
MAVD-MANNURONIC ACIDA1HV60.81
AOSD-ALLOSEA,B,C,D2I570.81
SSH3-DEOXY-D-ARABINO-HEXONIC ACIDA,B,C,D1W3N0.79
GC12,6-ANHYDRO-L-GULONIC ACIDA1HUA0.87
TGUTRIGALACTURONIC ACIDA2V8K0.76
TAGD-tagatoseA,B,C,D2QUM0.73
DNOD-mannoseA3BDK0.81
GTRGALACTURONIC ACIDA1KCD0.81
GTRGALACTURONIC ACIDA1KCC0.81
GTRGALACTURONIC ACIDA1N7Q0.81
FUDD-fructoseA,B,C,D2QUN0.73
DXG4-DEOXYGLUCARATEA,B,C,D1ECQ0.83
CKP(2R,3R,4S,5R)-2,3,4-TRIHYDROXY-
5-[(PHOSPHONATOOXY)METHYL]TETRAHYDROFURAN-
2-CARBOXYLIC ACID
A,B,C,D,E,F,
G,H,I,J,K,L
2DCN0.78
GKRD-GLUCARATEA3CXT0.84
GKRD-GLUCARATEA,B1JCT0.84
KO2prop-2-en-1-yl D-glycero-alpha-
D-talo-oct-2-ulopyranosidonic acid
A,B2R2H0.71
LGC(3S,4R,5R,6S)-3,4,5-TRIHYDROXY-
6-(HYDROXYMETHYL)TETRAHYDRO-2H-
PYRAN-2-ONE
M1E6X0.85
LGC(3S,4R,5R,6S)-3,4,5-TRIHYDROXY-
6-(HYDROXYMETHYL)TETRAHYDRO-2H-
PYRAN-2-ONE
A,B2E400.85
LGC(3S,4R,5R,6S)-3,4,5-TRIHYDROXY-
6-(HYDROXYMETHYL)TETRAHYDRO-2H-
PYRAN-2-ONE
A2VWG0.85
LGC(3S,4R,5R,6S)-3,4,5-TRIHYDROXY-
6-(HYDROXYMETHYL)TETRAHYDRO-2H-
PYRAN-2-ONE
A,B3EQO0.85
KBG2-KETO-BETA-D-GLUCOSEA2F5V0.74
KBG2-KETO-BETA-D-GLUCOSEA1FQ70.74
RNSL-RHAMNOSEA,B,C,D1X8D0.78
RNSL-RHAMNOSEA,B,C,D1DE60.78
RNSL-RHAMNOSEA,B,C,D2I560.78
IDX2-O-sulfo-alpha-L-gulopyranuronic acid11QQP0.78
1NT(2R,4R,5R,6R,7R)-2,4,5,6,7-PENTAHYDROXY-
2,8-BIS(PHOSPHONOOXY)OCTANOIC ACID
A,B2NXG0.71
1NT(2R,4R,5R,6R,7R)-2,4,5,6,7-PENTAHYDROXY-
2,8-BIS(PHOSPHONOOXY)OCTANOIC ACID
A,B,C,D,E,F,
G,H,I,J,K,L
2NX30.71
GCT4,5-DIHYDROXY-TETRAHYDRO-PYRAN-
2-CARBOXYLIC ACID
A1RWG0.83
GCT4,5-DIHYDROXY-TETRAHYDRO-PYRAN-
2-CARBOXYLIC ACID
A1RWF0.83
GCT4,5-DIHYDROXY-TETRAHYDRO-PYRAN-
2-CARBOXYLIC ACID
A1RWH0.83
KDP2-KETO-DEOXY-GALACTOSEA2V820.75
ADAALPHA-D-GALACTOPYRANURONIC ACIDC,D2NST0.81
ADAALPHA-D-GALACTOPYRANURONIC ACIDA1GXO0.81
ADAALPHA-D-GALACTOPYRANURONIC ACIDA2EWE0.81
ADAALPHA-D-GALACTOPYRANURONIC ACIDA2UVH0.81
ADAALPHA-D-GALACTOPYRANURONIC ACIDA2O040.81
ADAALPHA-D-GALACTOPYRANURONIC ACIDC,D2NTB0.81
ADAALPHA-D-GALACTOPYRANURONIC ACIDC,D2NT90.81
ADAALPHA-D-GALACTOPYRANURONIC ACIDA2NZM0.81
ADAALPHA-D-GALACTOPYRANURONIC ACIDA,B2Z8S0.81
ADAALPHA-D-GALACTOPYRANURONIC ACIDA2UVJ0.81
ADAALPHA-D-GALACTOPYRANURONIC ACIDA2O0V0.81
ADAALPHA-D-GALACTOPYRANURONIC ACIDC,D2NSP0.81
ADAALPHA-D-GALACTOPYRANURONIC ACIDA,B3B8Y0.81
ADAALPHA-D-GALACTOPYRANURONIC ACIDC,D2NT60.81
ADAALPHA-D-GALACTOPYRANURONIC ACIDA2O170.81
ADAALPHA-D-GALACTOPYRANURONIC ACIDC,D2NTP0.81
ADAALPHA-D-GALACTOPYRANURONIC ACIDA2O1D0.81
ADAALPHA-D-GALACTOPYRANURONIC ACIDC,D2NTQ0.81
LGUALPHA-L-GULURONATEA2ZAC0.81
LGUALPHA-L-GULURONATEA2ZAA0.81
LGUALPHA-L-GULURONATEA,B2QJR0.81
LGUALPHA-L-GULURONATEA2ZAB0.81
LGUALPHA-L-GULURONATEA,B1J1N0.81
LGUALPHA-L-GULURONATEA1Y3P0.81
46D(4AR,6R,7S,8R,8AR)-8-((5R,6R)-3-
CARBOXY-TETRAHYDRO-4,5,6-TRIHYDROXY-
2H-PYRAN-2-YLOXY)-HEXAHYDRO-6,7-
DIHYDROXY-2-METHYLPYRANO[3,2-D][1,3]DIOXINE-
2-CARBOXYLIC ACID)
A1X1J0.78
149D-GALCTOPYRANOSYL-1-ONA,B,C,D1JZ50.85
149D-GALCTOPYRANOSYL-1-ONA,B,C,D3CZJ0.85
G6QGLUCOSE-6-PHOSPHATEA,B3FF10.75
G6QGLUCOSE-6-PHOSPHATEA,B,C2O2C0.75
G6QGLUCOSE-6-PHOSPHATEA,B2J6H0.75
G6QGLUCOSE-6-PHOSPHATEA,B1JXA0.75
G6QGLUCOSE-6-PHOSPHATEA,B1U0F0.75
G6QGLUCOSE-6-PHOSPHATEA,B1X9I0.75
IDSO2-SULFO-GLUCURONIC ACID11ZBA0.78
IDSO2-SULFO-GLUCURONIC ACIDA2HYV0.78
IDSO2-SULFO-GLUCURONIC ACIDA1BFC0.78
IDSO2-SULFO-GLUCURONIC ACIDA,B,C,D2VRA0.78
IDSO2-SULFO-GLUCURONIC ACIDH,I3B9F0.78
IDSO2-SULFO-GLUCURONIC ACIDB,C,D,E1E0O0.78
IDSO2-SULFO-GLUCURONIC ACIDA2HYU0.78
IDSO2-SULFO-GLUCURONIC ACIDA,B3DY00.78
IDSO2-SULFO-GLUCURONIC ACIDB2AXM0.78
IDSO2-SULFO-GLUCURONIC ACIDA,B1FQ90.78
IDSO2-SULFO-GLUCURONIC ACIDA1BFB0.78
IDSO2-SULFO-GLUCURONIC ACIDA,B1T8U0.78
IDSO2-SULFO-GLUCURONIC ACIDA,B1GMN0.78
IDSO2-SULFO-GLUCURONIC ACIDA1XT30.78
IDSO2-SULFO-GLUCURONIC ACIDA,B,C,D,E,F1AXM0.78
IDSO2-SULFO-GLUCURONIC ACIDA,B,C,D,E,F,
G,H
1GMO0.78
IDSO2-SULFO-GLUCURONIC ACIDA2ERM0.78
IDSO2-SULFO-GLUCURONIC ACIDB,D,F,H1XMN0.78
IDSO2-SULFO-GLUCURONIC ACIDA1HPN0.78
IDSO2-SULFO-GLUCURONIC ACIDA1G5N0.78
IDSO2-SULFO-GLUCURONIC ACID11QQP0.78
IDSO2-SULFO-GLUCURONIC ACIDA,B1RID0.78
AD0DIGALACTURONIC ACIDA,B2UVF0.81
M8CMETHYL ALPHA-D-GALACTOPYRANURONATEC,D2NST0.82
M8CMETHYL ALPHA-D-GALACTOPYRANURONATEC,D2NSP0.82
M8CMETHYL ALPHA-D-GALACTOPYRANURONATEC,D2NT90.82
M8CMETHYL ALPHA-D-GALACTOPYRANURONATEC,D2NTQ0.82
M8CMETHYL ALPHA-D-GALACTOPYRANURONATEC,D2NTP0.82
M8CMETHYL ALPHA-D-GALACTOPYRANURONATEC,D2NT60.82
KDF3-deoxy-alpha-D-erythro-hex-2-ulofuranosonic acidA,B,C2VAR0.81
LFC6-DEOXY-L-GALACTONIC ACIDA2HXU0.84
KDG2-KETO-3-DEOXYGLUCONATEA,B1V1A0.81
KDG2-KETO-3-DEOXYGLUCONATEA,B,C2VAR0.81
KDG2-KETO-3-DEOXYGLUCONATEA,B,C,D2QJN0.81
KO1D-glycero-alpha-D-talo-oct-2-ulopyranosonic acidA,B2R230.82
LG6L-GULURONIC ACID 6-PHOSPHATEA,B1KW10.77
LG6L-GULURONIC ACID 6-PHOSPHATEA,B1Q6O0.77
GU22,3-DI-O-METHYL-ALPHA-L-IDOPYRANURONIC ACIDA,B,D,I2B5T0.83
GU22,3-DI-O-METHYL-ALPHA-L-IDOPYRANURONIC ACIDH,I1TB60.83
LGTL-GLUCARIC ACIDA,B,C,D3CB30.84
LGTL-GLUCARIC ACIDA,B,C2PP30.84
BEMbeta-D-mannuronic acidA2ZAA0.81
BEMbeta-D-mannuronic acidA2ZAC0.81
BEMbeta-D-mannuronic acidA2ZAB0.81
BEMbeta-D-mannuronic acidA1Y3N0.81
BEMbeta-D-mannuronic acidA1Y3P0.81
BEMbeta-D-mannuronic acidA,B1J1N0.81
SHBmethyl beta-D-galactopyranuronateC,D2NTP0.82
3MF3-O-METHYLFRUCTOSE IN LINEAR FORMA,B1XYC0.8
XLSD-XYLOSE (LINEAR FORM)A,B2QW50.71
XLSD-XYLOSE (LINEAR FORM)A2BRP0.71
XLSD-XYLOSE (LINEAR FORM)A3XIS0.71
XLSD-XYLOSE (LINEAR FORM)A,B,C,D8XIM0.71
XLSD-XYLOSE (LINEAR FORM)A4XIS0.71
XLSD-XYLOSE (LINEAR FORM)A,B,C,D9XIM0.71
XLSD-XYLOSE (LINEAR FORM)A,B,C,D5XIN0.71
XLSD-XYLOSE (LINEAR FORM)A8XIA0.71
XLSD-XYLOSE (LINEAR FORM)A,B,C,D6XIM0.71
XLSD-XYLOSE (LINEAR FORM)A1XIC0.71
CS2D-MANNONIC ACIDA,B,C,D2QJM0.83
CS2D-MANNONIC ACIDA,B3DBN0.83
KDO3-DEOXY-D-MANNO-OCT-2-ULOSONIC ACIDA,B,C1Q9W0.79
KDO3-DEOXY-D-MANNO-OCT-2-ULOSONIC ACIDA,B3DUV0.79
KDO3-DEOXY-D-MANNO-OCT-2-ULOSONIC ACIDA,B,C,D3DUS0.79
KDO3-DEOXY-D-MANNO-OCT-2-ULOSONIC ACIDA1QJQ0.79
KDO3-DEOXY-D-MANNO-OCT-2-ULOSONIC ACIDA,B1Q9R0.79
KDO3-DEOXY-D-MANNO-OCT-2-ULOSONIC ACIDA1QFF0.79
KDO3-DEOXY-D-MANNO-OCT-2-ULOSONIC ACIDA2FCP0.79
KDO3-DEOXY-D-MANNO-OCT-2-ULOSONIC ACIDA,B1Q9Q0.79
KDO3-DEOXY-D-MANNO-OCT-2-ULOSONIC ACIDA,B3DV40.79
KDO3-DEOXY-D-MANNO-OCT-2-ULOSONIC ACIDA,B,C,D3FXI0.79
KDO3-DEOXY-D-MANNO-OCT-2-ULOSONIC ACIDA,B2R2B0.79
KDO3-DEOXY-D-MANNO-OCT-2-ULOSONIC ACIDA1FCP0.79
KDO3-DEOXY-D-MANNO-OCT-2-ULOSONIC ACIDA1FI10.79
KDO3-DEOXY-D-MANNO-OCT-2-ULOSONIC ACIDA,B,C,D3DUU0.79
KDO3-DEOXY-D-MANNO-OCT-2-ULOSONIC ACIDA,B1Q9V0.79
KDO3-DEOXY-D-MANNO-OCT-2-ULOSONIC ACIDA1QFG0.79
KDO3-DEOXY-D-MANNO-OCT-2-ULOSONIC ACIDA1QKC0.79
KDO3-DEOXY-D-MANNO-OCT-2-ULOSONIC ACIDA,B,C,D3DUR0.79
KDO3-DEOXY-D-MANNO-OCT-2-ULOSONIC ACIDA,B2R1Y0.79
KDO3-DEOXY-D-MANNO-OCT-2-ULOSONIC ACIDA,B1Q9T0.79
KDO3-DEOXY-D-MANNO-OCT-2-ULOSONIC ACIDA,B3DV60.79
KDO3-DEOXY-D-MANNO-OCT-2-ULOSONIC ACIDA,B2GRX0.79
GLR2,3-DIHYDROXY-5-OXO-HEXANEDIOATEA,B,C,D1EC80.77
GLR2,3-DIHYDROXY-5-OXO-HEXANEDIOATEA,B,C,D1JDF0.77
RSH3-DEOXY-D-LYXO-HEXONIC ACIDA,B,C,D1W3T0.79
GU12,3-DI-O-METHYL-BETA-D-GLUCOPYRANURONIC ACIDH,I1TB60.83
GU12,3-DI-O-METHYL-BETA-D-GLUCOPYRANURONIC ACIDA,B,D,I2B5T0.83
GCOGLUCONIC ACIDB,C,D1BGG0.83
GCOGLUCONIC ACIDA,B1XLF0.83
BDPBETA-D-GALACTOPYRANURONIC ACIDA1N7R0.81
BDPBETA-D-GALACTOPYRANURONIC ACIDA3C9E0.81
BDPBETA-D-GALACTOPYRANURONIC ACIDA1LOH0.81
BDPBETA-D-GALACTOPYRANURONIC ACIDA1CAP0.81
BDPBETA-D-GALACTOPYRANURONIC ACIDA1HM30.81
BDPBETA-D-GALACTOPYRANURONIC ACIDA1HUA0.81
BDPBETA-D-GALACTOPYRANURONIC ACIDA1LXK0.81
BDPBETA-D-GALACTOPYRANURONIC ACIDA,B1GQK0.81
BDPBETA-D-GALACTOPYRANURONIC ACIDA,B1ON80.81
BDPBETA-D-GALACTOPYRANURONIC ACIDP2BVK0.81
BDPBETA-D-GALACTOPYRANURONIC ACIDA2JCR0.81
BDPBETA-D-GALACTOPYRANURONIC ACIDA1LXM0.81
BDPBETA-D-GALACTOPYRANURONIC ACIDA1HMW0.81
BDPBETA-D-GALACTOPYRANURONIC ACIDA3HYA0.81
BDPBETA-D-GALACTOPYRANURONIC ACIDA,B1GQL0.81
BDPBETA-D-GALACTOPYRANURONIC ACIDA1OFM0.81
BDPBETA-D-GALACTOPYRANURONIC ACIDA1N7Q0.81
I1N(2S,3R,4R,5S,6S)-2,3,4,5,6-PENTAHYDROXYCYCLOHEXANONEA,B2IBN0.74
GCUD-GLUCURONIC ACIDA1HMW0.81
GCUD-GLUCURONIC ACIDA2JCQ0.81
GCUD-GLUCURONIC ACIDA3HYA0.81
GCUD-GLUCURONIC ACIDA,B2FUQ0.81
GCUD-GLUCURONIC ACIDA1DBG0.81
GCUD-GLUCURONIC ACIDA1FCV0.81
GCUD-GLUCURONIC ACIDA1OFM0.81
GCUD-GLUCURONIC ACIDA,B3E7J0.81
GCUD-GLUCURONIC ACIDA1CB80.81
GCUD-GLUCURONIC ACIDA1HV60.81
GCUD-GLUCURONIC ACIDA1HMU0.81
GCUD-GLUCURONIC ACIDA,B,C3E800.81
GCUD-GLUCURONIC ACIDA,B2VZR0.81
GCUD-GLUCURONIC ACIDA2HYA0.81
GCUD-GLUCURONIC ACIDA1OFL0.81
GCUD-GLUCURONIC ACIDA,B2W870.81
GCUD-GLUCURONIC ACIDA1MQQ0.81
GCUD-GLUCURONIC ACIDA1HM20.81
GCUD-GLUCURONIC ACIDA1HYA0.81
GCUD-GLUCURONIC ACIDA2C4S0.81
GCUD-GLUCURONIC ACIDA4HYA0.81
GCUD-GLUCURONIC ACIDA1C4S0.81
GCUD-GLUCURONIC ACIDA1HM30.81
GCUD-GLUCURONIC ACIDA1DBO0.81
DO83-DEOXY-D-MANNO-2-OCTULOSONATE-
8-PHOSPHATE
A1X6U0.72
6PG6-PHOSPHOGLUCONIC ACIDA1PGP0.77
6PG6-PHOSPHOGLUCONIC ACIDA,B1J3R0.77
6PG6-PHOSPHOGLUCONIC ACIDA,B1QY40.77
6PG6-PHOSPHOGLUCONIC ACIDA,B2W8Z0.77
6PG6-PHOSPHOGLUCONIC ACIDA,B3E7F0.77
6PG6-PHOSPHOGLUCONIC ACIDA,B2W900.77
6PG6-PHOSPHOGLUCONIC ACIDA,B1KO80.77
6PG6-PHOSPHOGLUCONIC ACIDA,B2CXR0.77
6PG6-PHOSPHOGLUCONIC ACIDA2IYO0.77
6PG6-PHOSPHOGLUCONIC ACIDA,B1DQR0.77
DG04-O-alpha-D-galactopyranuronosyl-
alpha-D-galactopyranuronic acid
A3DYB0.81
GCV4-O-METHYL-ALPHA-D-GLUCURONIC ACIDA1K9E0.83
GCV4-O-METHYL-ALPHA-D-GLUCURONIC ACIDA,B1V6X0.83
GCV4-O-METHYL-ALPHA-D-GLUCURONIC ACIDA1UQZ0.83
GCV4-O-METHYL-ALPHA-D-GLUCURONIC ACIDA,B1H410.83
GCV4-O-METHYL-ALPHA-D-GLUCURONIC ACIDA1K9F0.83
GCV4-O-METHYL-ALPHA-D-GLUCURONIC ACIDA,B1V6W0.83
KD03-deoxy-8-O-phosphono-D-manno-oct-
2-ulosonic acid
A,B3E120.72
GLOD-GLUCOSE IN LINEAR FORMA,B1XYB0.81
GLOD-GLUCOSE IN LINEAR FORMA1FQD0.81
GLOD-GLUCOSE IN LINEAR FORMA,B1XYM0.81
GLOD-GLUCOSE IN LINEAR FORMA,B1EZ90.81
GLOD-GLUCOSE IN LINEAR FORMA1FBO0.81
GLOD-GLUCOSE IN LINEAR FORMA1AC00.81
GLOD-GLUCOSE IN LINEAR FORMA1FQC0.81
3LR3,6-dideoxy-L-arabino-hexonic acidA,B3CXO0.81
GCW4-O-METHYL-BETA-D-GLUCURONIC ACIDA1L8N0.83
GC44-DEOXY-D-GLUCURONIC ACIDA1I8Q0.78
GC44-DEOXY-D-GLUCURONIC ACIDA1C4S0.78
GC44-DEOXY-D-GLUCURONIC ACIDA1DBO0.78
IDU2-O-sulfo-beta-L-altropyranuronic acidA,B2BRS0.78
IDU2-O-sulfo-beta-L-altropyranuronic acidA,B1FQ90.78
FKD2,6-ANHYDRO-3-DEOXY-3-FLUORO-L-
ARABINO-D-GALACTO-NONONIC ACID
A2AGS0.79