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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03781957

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
KDG2-KETO-3-DEOXYGLUCONATEA,B1V1A0.83
KDG2-KETO-3-DEOXYGLUCONATEA,B,C2VAR0.83
KDG2-KETO-3-DEOXYGLUCONATEA,B,C,D2QJN0.83
AOSD-ALLOSEA,B,C,D2I570.76
TAGD-tagatoseA,B,C,D2QUM0.74
LGTL-GLUCARIC ACIDA,B,C,D3CB30.83
LGTL-GLUCARIC ACIDA,B,C2PP30.83
SHBmethyl beta-D-galactopyranuronateC,D2NTP0.89
LGC(3S,4R,5R,6S)-3,4,5-TRIHYDROXY-
6-(HYDROXYMETHYL)TETRAHYDRO-2H-
PYRAN-2-ONE
M1E6X0.86
LGC(3S,4R,5R,6S)-3,4,5-TRIHYDROXY-
6-(HYDROXYMETHYL)TETRAHYDRO-2H-
PYRAN-2-ONE
A,B2E400.86
LGC(3S,4R,5R,6S)-3,4,5-TRIHYDROXY-
6-(HYDROXYMETHYL)TETRAHYDRO-2H-
PYRAN-2-ONE
A2VWG0.86
LGC(3S,4R,5R,6S)-3,4,5-TRIHYDROXY-
6-(HYDROXYMETHYL)TETRAHYDRO-2H-
PYRAN-2-ONE
A,B3EQO0.86
AD0DIGALACTURONIC ACIDA,B2UVF0.82
IDX2-O-sulfo-alpha-L-gulopyranuronic acid11QQP0.85
FUDD-fructoseA,B,C,D2QUN0.74
149D-GALCTOPYRANOSYL-1-ONA,B,C,D1JZ50.86
149D-GALCTOPYRANOSYL-1-ONA,B,C,D3CZJ0.86
DNOD-mannoseA3BDK0.76
IDSO2-SULFO-GLUCURONIC ACID11ZBA0.85
IDSO2-SULFO-GLUCURONIC ACIDA2HYV0.85
IDSO2-SULFO-GLUCURONIC ACIDA1BFC0.85
IDSO2-SULFO-GLUCURONIC ACIDA,B,C,D2VRA0.85
IDSO2-SULFO-GLUCURONIC ACIDH,I3B9F0.85
IDSO2-SULFO-GLUCURONIC ACIDB,C,D,E1E0O0.85
IDSO2-SULFO-GLUCURONIC ACIDA2HYU0.85
IDSO2-SULFO-GLUCURONIC ACIDA,B3DY00.85
IDSO2-SULFO-GLUCURONIC ACIDB2AXM0.85
IDSO2-SULFO-GLUCURONIC ACIDA,B1FQ90.85
IDSO2-SULFO-GLUCURONIC ACIDA1BFB0.85
IDSO2-SULFO-GLUCURONIC ACIDA,B1T8U0.85
IDSO2-SULFO-GLUCURONIC ACIDA,B1GMN0.85
IDSO2-SULFO-GLUCURONIC ACIDA1XT30.85
IDSO2-SULFO-GLUCURONIC ACIDA,B,C,D,E,F1AXM0.85
IDSO2-SULFO-GLUCURONIC ACIDA,B,C,D,E,F,
G,H
1GMO0.85
IDSO2-SULFO-GLUCURONIC ACIDA2ERM0.85
IDSO2-SULFO-GLUCURONIC ACIDB,D,F,H1XMN0.85
IDSO2-SULFO-GLUCURONIC ACIDA1HPN0.85
IDSO2-SULFO-GLUCURONIC ACIDA1G5N0.85
IDSO2-SULFO-GLUCURONIC ACID11QQP0.85
IDSO2-SULFO-GLUCURONIC ACIDA,B1RID0.85
SSH3-DEOXY-D-ARABINO-HEXONIC ACIDA,B,C,D1W3N0.81
GCUD-GLUCURONIC ACIDA1HMW0.92
GCUD-GLUCURONIC ACIDA2JCQ0.92
GCUD-GLUCURONIC ACIDA3HYA0.92
GCUD-GLUCURONIC ACIDA,B2FUQ0.92
GCUD-GLUCURONIC ACIDA1DBG0.92
GCUD-GLUCURONIC ACIDA1FCV0.92
GCUD-GLUCURONIC ACIDA1OFM0.92
GCUD-GLUCURONIC ACIDA,B3E7J0.92
GCUD-GLUCURONIC ACIDA1CB80.92
GCUD-GLUCURONIC ACIDA1HV60.92
GCUD-GLUCURONIC ACIDA1HMU0.92
GCUD-GLUCURONIC ACIDA,B,C3E800.92
GCUD-GLUCURONIC ACIDA,B2VZR0.92
GCUD-GLUCURONIC ACIDA2HYA0.92
GCUD-GLUCURONIC ACIDA1OFL0.92
GCUD-GLUCURONIC ACIDA,B2W870.92
GCUD-GLUCURONIC ACIDA1MQQ0.92
GCUD-GLUCURONIC ACIDA1HM20.92
GCUD-GLUCURONIC ACIDA1HYA0.92
GCUD-GLUCURONIC ACIDA2C4S0.92
GCUD-GLUCURONIC ACIDA4HYA0.92
GCUD-GLUCURONIC ACIDA1C4S0.92
GCUD-GLUCURONIC ACIDA1HM30.92
GCUD-GLUCURONIC ACIDA1DBO0.92
BDPBETA-D-GALACTOPYRANURONIC ACIDA1N7R0.92
BDPBETA-D-GALACTOPYRANURONIC ACIDA3C9E0.92
BDPBETA-D-GALACTOPYRANURONIC ACIDA1LOH0.92
BDPBETA-D-GALACTOPYRANURONIC ACIDA1CAP0.92
BDPBETA-D-GALACTOPYRANURONIC ACIDA1HM30.92
BDPBETA-D-GALACTOPYRANURONIC ACIDA1HUA0.92
BDPBETA-D-GALACTOPYRANURONIC ACIDA1LXK0.92
BDPBETA-D-GALACTOPYRANURONIC ACIDA,B1GQK0.92
BDPBETA-D-GALACTOPYRANURONIC ACIDA,B1ON80.92
BDPBETA-D-GALACTOPYRANURONIC ACIDP2BVK0.92
BDPBETA-D-GALACTOPYRANURONIC ACIDA2JCR0.92
BDPBETA-D-GALACTOPYRANURONIC ACIDA1LXM0.92
BDPBETA-D-GALACTOPYRANURONIC ACIDA1HMW0.92
BDPBETA-D-GALACTOPYRANURONIC ACIDA3HYA0.92
BDPBETA-D-GALACTOPYRANURONIC ACIDA,B1GQL0.92
BDPBETA-D-GALACTOPYRANURONIC ACIDA1OFM0.92
BDPBETA-D-GALACTOPYRANURONIC ACIDA1N7Q0.92
GZLBETA-D-GALACTOFURANOSEA2VK20.74
KDO3-DEOXY-D-MANNO-OCT-2-ULOSONIC ACIDA,B,C1Q9W0.77
KDO3-DEOXY-D-MANNO-OCT-2-ULOSONIC ACIDA,B3DUV0.77
KDO3-DEOXY-D-MANNO-OCT-2-ULOSONIC ACIDA,B,C,D3DUS0.77
KDO3-DEOXY-D-MANNO-OCT-2-ULOSONIC ACIDA1QJQ0.77
KDO3-DEOXY-D-MANNO-OCT-2-ULOSONIC ACIDA,B1Q9R0.77
KDO3-DEOXY-D-MANNO-OCT-2-ULOSONIC ACIDA1QFF0.77
KDO3-DEOXY-D-MANNO-OCT-2-ULOSONIC ACIDA2FCP0.77
KDO3-DEOXY-D-MANNO-OCT-2-ULOSONIC ACIDA,B1Q9Q0.77
KDO3-DEOXY-D-MANNO-OCT-2-ULOSONIC ACIDA,B3DV40.77
KDO3-DEOXY-D-MANNO-OCT-2-ULOSONIC ACIDA,B,C,D3FXI0.77
KDO3-DEOXY-D-MANNO-OCT-2-ULOSONIC ACIDA,B2R2B0.77
KDO3-DEOXY-D-MANNO-OCT-2-ULOSONIC ACIDA1FCP0.77
KDO3-DEOXY-D-MANNO-OCT-2-ULOSONIC ACIDA1FI10.77
KDO3-DEOXY-D-MANNO-OCT-2-ULOSONIC ACIDA,B,C,D3DUU0.77
KDO3-DEOXY-D-MANNO-OCT-2-ULOSONIC ACIDA,B1Q9V0.77
KDO3-DEOXY-D-MANNO-OCT-2-ULOSONIC ACIDA1QFG0.77
KDO3-DEOXY-D-MANNO-OCT-2-ULOSONIC ACIDA1QKC0.77
KDO3-DEOXY-D-MANNO-OCT-2-ULOSONIC ACIDA,B,C,D3DUR0.77
KDO3-DEOXY-D-MANNO-OCT-2-ULOSONIC ACIDA,B2R1Y0.77
KDO3-DEOXY-D-MANNO-OCT-2-ULOSONIC ACIDA,B1Q9T0.77
KDO3-DEOXY-D-MANNO-OCT-2-ULOSONIC ACIDA,B3DV60.77
KDO3-DEOXY-D-MANNO-OCT-2-ULOSONIC ACIDA,B2GRX0.77
3MF3-O-METHYLFRUCTOSE IN LINEAR FORMA,B1XYC0.75
CS2D-MANNONIC ACIDA,B,C,D2QJM0.84
CS2D-MANNONIC ACIDA,B3DBN0.84
GCT4,5-DIHYDROXY-TETRAHYDRO-PYRAN-
2-CARBOXYLIC ACID
A1RWG0.82
GCT4,5-DIHYDROXY-TETRAHYDRO-PYRAN-
2-CARBOXYLIC ACID
A1RWF0.82
GCT4,5-DIHYDROXY-TETRAHYDRO-PYRAN-
2-CARBOXYLIC ACID
A1RWH0.82
DSU((2R,3S,4S,5S)-3,4-DIHYDROXY-5-
(HYDROXYMETHYL)-5-((2R,3S,4S,5S,6R)-
3,4,5-TRIHYDROXY-6-METHOXY-TETRAHYDRO-
2H-PYRAN-2-YLOXY)-TETRAHYDROFURAN-
2-YL)METHYL NONANOATE
A,B2FCT0.7
DSU((2R,3S,4S,5S)-3,4-DIHYDROXY-5-
(HYDROXYMETHYL)-5-((2R,3S,4S,5S,6R)-
3,4,5-TRIHYDROXY-6-METHOXY-TETRAHYDRO-
2H-PYRAN-2-YLOXY)-TETRAHYDROFURAN-
2-YL)METHYL NONANOATE
A,B2FCV0.7
DSU((2R,3S,4S,5S)-3,4-DIHYDROXY-5-
(HYDROXYMETHYL)-5-((2R,3S,4S,5S,6R)-
3,4,5-TRIHYDROXY-6-METHOXY-TETRAHYDRO-
2H-PYRAN-2-YLOXY)-TETRAHYDROFURAN-
2-YL)METHYL NONANOATE
A,B2FCU0.7
RNSL-RHAMNOSEA,B,C,D1X8D0.7
RNSL-RHAMNOSEA,B,C,D1DE60.7
RNSL-RHAMNOSEA,B,C,D2I560.7
KBG2-KETO-BETA-D-GLUCOSEA2F5V0.84
KBG2-KETO-BETA-D-GLUCOSEA1FQ70.84
20SBETA-D-FRUCTOFURANOSYL 6-O-OCTANOYL-
ALPHA-D-GLUCOPYRANOSIDE
A,B2FAF0.7
20SBETA-D-FRUCTOFURANOSYL 6-O-OCTANOYL-
ALPHA-D-GLUCOPYRANOSIDE
A,B,C,D2FAH0.7
20SBETA-D-FRUCTOFURANOSYL 6-O-OCTANOYL-
ALPHA-D-GLUCOPYRANOSIDE
A,B2QZY0.7
FRUFRUCTOSEA1FIT0.7
FRUFRUCTOSEA,B,C,D,E,F,
G,H,S,T
3B750.7
FRUFRUCTOSEA,B,C1AF60.7
FRUFRUCTOSEA,B,C2INV0.7
FRUFRUCTOSEA1Y9G0.7
FRUFRUCTOSEA2O510.7
FRUFRUCTOSEA,B1N3P0.7
FRUFRUCTOSEA,B,C,D2HK10.7
FRUFRUCTOSEB,C,F,H,I,K,L2DD40.7
FRUFRUCTOSEA,B,C,D2I580.7
FRUFRUCTOSEA,C1LES0.7
FRUFRUCTOSEA2ADE0.7
FRUFRUCTOSEA,B3BRQ0.7
FRUFRUCTOSEA2HW10.7
FRUFRUCTOSEA2FIT0.7
FRUFRUCTOSEA3FIT0.7
FRUFRUCTOSEA,B1N3Q0.7
FRUFRUCTOSEA2DWJ0.7
BEMbeta-D-mannuronic acidA2ZAA0.92
BEMbeta-D-mannuronic acidA2ZAC0.92
BEMbeta-D-mannuronic acidA2ZAB0.92
BEMbeta-D-mannuronic acidA1Y3N0.92
BEMbeta-D-mannuronic acidA1Y3P0.92
BEMbeta-D-mannuronic acidA,B1J1N0.92
GCOGLUCONIC ACIDB,C,D1BGG0.84
GCOGLUCONIC ACIDA,B1XLF0.84
DO83-DEOXY-D-MANNO-2-OCTULOSONATE-
8-PHOSPHATE
A1X6U0.71
FKD2,6-ANHYDRO-3-DEOXY-3-FLUORO-L-
ARABINO-D-GALACTO-NONONIC ACID
A2AGS0.72
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
2DCN0.85
GC44-DEOXY-D-GLUCURONIC ACIDA1I8Q0.88
GC44-DEOXY-D-GLUCURONIC ACIDA1C4S0.88
GC44-DEOXY-D-GLUCURONIC ACIDA1DBO0.88
KDP2-KETO-DEOXY-GALACTOSEA2V820.74
2OS3-N-OCTANOYLSUCROSEA,B1T3I0.7
DG04-O-alpha-D-galactopyranuronosyl-
alpha-D-galactopyranuronic acid
A3DYB0.82
GLR2,3-DIHYDROXY-5-OXO-HEXANEDIOATEA,B,C,D1EC80.78
GLR2,3-DIHYDROXY-5-OXO-HEXANEDIOATEA,B,C,D1JDF0.78
RSH3-DEOXY-D-LYXO-HEXONIC ACIDA,B,C,D1W3T0.81
LGUALPHA-L-GULURONATEA2ZAC0.92
LGUALPHA-L-GULURONATEA2ZAA0.92
LGUALPHA-L-GULURONATEA,B2QJR0.92
LGUALPHA-L-GULURONATEA2ZAB0.92
LGUALPHA-L-GULURONATEA,B1J1N0.92
LGUALPHA-L-GULURONATEA1Y3P0.92
ADAALPHA-D-GALACTOPYRANURONIC ACIDC,D2NST0.92
ADAALPHA-D-GALACTOPYRANURONIC ACIDA1GXO0.92
ADAALPHA-D-GALACTOPYRANURONIC ACIDA2EWE0.92
ADAALPHA-D-GALACTOPYRANURONIC ACIDA2UVH0.92
ADAALPHA-D-GALACTOPYRANURONIC ACIDA2O040.92
ADAALPHA-D-GALACTOPYRANURONIC ACIDC,D2NTB0.92
ADAALPHA-D-GALACTOPYRANURONIC ACIDC,D2NT90.92
ADAALPHA-D-GALACTOPYRANURONIC ACIDA2NZM0.92
ADAALPHA-D-GALACTOPYRANURONIC ACIDA,B2Z8S0.92
ADAALPHA-D-GALACTOPYRANURONIC ACIDA2UVJ0.92
ADAALPHA-D-GALACTOPYRANURONIC ACIDA2O0V0.92
ADAALPHA-D-GALACTOPYRANURONIC ACIDC,D2NSP0.92
ADAALPHA-D-GALACTOPYRANURONIC ACIDA,B3B8Y0.92
ADAALPHA-D-GALACTOPYRANURONIC ACIDC,D2NT60.92
ADAALPHA-D-GALACTOPYRANURONIC ACIDA2O170.92
ADAALPHA-D-GALACTOPYRANURONIC ACIDC,D2NTP0.92
ADAALPHA-D-GALACTOPYRANURONIC ACIDA2O1D0.92
ADAALPHA-D-GALACTOPYRANURONIC ACIDC,D2NTQ0.92
TGUTRIGALACTURONIC ACIDA2V8K0.77
DXG4-DEOXYGLUCARATEA,B,C,D1ECQ0.84
IDU2-O-sulfo-beta-L-altropyranuronic acidA,B2BRS0.85
IDU2-O-sulfo-beta-L-altropyranuronic acidA,B1FQ90.85
6PG6-PHOSPHOGLUCONIC ACIDA1PGP0.75
6PG6-PHOSPHOGLUCONIC ACIDA,B1J3R0.75
6PG6-PHOSPHOGLUCONIC ACIDA,B1QY40.75
6PG6-PHOSPHOGLUCONIC ACIDA,B2W8Z0.75
6PG6-PHOSPHOGLUCONIC ACIDA,B3E7F0.75
6PG6-PHOSPHOGLUCONIC ACIDA,B2W900.75
6PG6-PHOSPHOGLUCONIC ACIDA,B1KO80.75
6PG6-PHOSPHOGLUCONIC ACIDA,B2CXR0.75
6PG6-PHOSPHOGLUCONIC ACIDA2IYO0.75
6PG6-PHOSPHOGLUCONIC ACIDA,B1DQR0.75
KO1D-glycero-alpha-D-talo-oct-2-ulopyranosonic acidA,B2R230.8
GU12,3-DI-O-METHYL-BETA-D-GLUCOPYRANURONIC ACIDH,I1TB60.87
GU12,3-DI-O-METHYL-BETA-D-GLUCOPYRANURONIC ACIDA,B,D,I2B5T0.87
LFRBETA-L-FRUCTO-FURANOSEA2CGJ0.7
LFRBETA-L-FRUCTO-FURANOSEA2CGL0.7
LFRBETA-L-FRUCTO-FURANOSEA1ZX50.7
KDF3-deoxy-alpha-D-erythro-hex-2-ulofuranosonic acidA,B,C2VAR0.91
TFBTETRAHYDROFURAN-2-CARBOXYLIC ACIDA1TIW0.71
TFBTETRAHYDROFURAN-2-CARBOXYLIC ACIDA3E2R0.71
TFBTETRAHYDROFURAN-2-CARBOXYLIC ACIDA1KB00.71
1N5(2R,4S)-2,4,7-trihydroxyheptanoic acidA,B3CXO0.7
GTRGALACTURONIC ACIDA1KCD0.92
GTRGALACTURONIC ACIDA1KCC0.92
GTRGALACTURONIC ACIDA1N7Q0.92
OSUN-OCTANOYLSUCROSEA1PYY0.7
GCV4-O-METHYL-ALPHA-D-GLUCURONIC ACIDA1K9E0.9
GCV4-O-METHYL-ALPHA-D-GLUCURONIC ACIDA,B1V6X0.9
GCV4-O-METHYL-ALPHA-D-GLUCURONIC ACIDA1UQZ0.9
GCV4-O-METHYL-ALPHA-D-GLUCURONIC ACIDA,B1H410.9
GCV4-O-METHYL-ALPHA-D-GLUCURONIC ACIDA1K9F0.9
GCV4-O-METHYL-ALPHA-D-GLUCURONIC ACIDA,B1V6W0.9
3LR3,6-dideoxy-L-arabino-hexonic acidA,B3CXO0.79
M8CMETHYL ALPHA-D-GALACTOPYRANURONATEC,D2NST0.89
M8CMETHYL ALPHA-D-GALACTOPYRANURONATEC,D2NSP0.89
M8CMETHYL ALPHA-D-GALACTOPYRANURONATEC,D2NT90.89
M8CMETHYL ALPHA-D-GALACTOPYRANURONATEC,D2NTQ0.89
M8CMETHYL ALPHA-D-GALACTOPYRANURONATEC,D2NTP0.89
M8CMETHYL ALPHA-D-GALACTOPYRANURONATEC,D2NT60.89
GKRD-GLUCARATEA3CXT0.83
GKRD-GLUCARATEA,B1JCT0.83
2GL4-O-ACETYL-2,6-DIDEOXY-ALPHA-D-
GALACTO-HEXOPYRANOSE
A,B1EKH0.72
2GL4-O-ACETYL-2,6-DIDEOXY-ALPHA-D-
GALACTO-HEXOPYRANOSE
A,B1EKI0.72
GC12,6-ANHYDRO-L-GULONIC ACIDA1HUA0.85
GCW4-O-METHYL-BETA-D-GLUCURONIC ACIDA1L8N0.9
LFC6-DEOXY-L-GALACTONIC ACIDA2HXU0.83
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)
A1X1J0.76
MAVD-MANNURONIC ACIDA,B1J1N0.92
MAVD-MANNURONIC ACIDA1Y3P0.92
MAVD-MANNURONIC ACIDA,B,D2PYH0.92
MAVD-MANNURONIC ACIDA1Y3N0.92
MAVD-MANNURONIC ACIDA1HV60.92
GLOD-GLUCOSE IN LINEAR FORMA,B1XYB0.76
GLOD-GLUCOSE IN LINEAR FORMA1FQD0.76
GLOD-GLUCOSE IN LINEAR FORMA,B1XYM0.76
GLOD-GLUCOSE IN LINEAR FORMA,B1EZ90.76
GLOD-GLUCOSE IN LINEAR FORMA1FBO0.76
GLOD-GLUCOSE IN LINEAR FORMA1AC00.76
GLOD-GLUCOSE IN LINEAR FORMA1FQC0.76
GU22,3-DI-O-METHYL-ALPHA-L-IDOPYRANURONIC ACIDA,B,D,I2B5T0.87
GU22,3-DI-O-METHYL-ALPHA-L-IDOPYRANURONIC ACIDH,I1TB60.87
IDRL-IDURONIC ACIDA2V380.92
IDRL-IDURONIC ACIDA1HM20.92
IDRL-IDURONIC ACIDA2ERM0.92
LG6L-GULURONIC ACID 6-PHOSPHATEA,B1KW10.75
LG6L-GULURONIC ACID 6-PHOSPHATEA,B1Q6O0.75
I1N(2S,3R,4R,5S,6S)-2,3,4,5,6-PENTAHYDROXYCYCLOHEXANONEA,B2IBN0.75