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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03416730

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
BDPBETA-D-GALACTOPYRANURONIC ACIDA1N7R0.89
BDPBETA-D-GALACTOPYRANURONIC ACIDA3C9E0.89
BDPBETA-D-GALACTOPYRANURONIC ACIDA1LOH0.89
BDPBETA-D-GALACTOPYRANURONIC ACIDA1CAP0.89
BDPBETA-D-GALACTOPYRANURONIC ACIDA1HM30.89
BDPBETA-D-GALACTOPYRANURONIC ACIDA1HUA0.89
BDPBETA-D-GALACTOPYRANURONIC ACIDA1LXK0.89
BDPBETA-D-GALACTOPYRANURONIC ACIDA,B1GQK0.89
BDPBETA-D-GALACTOPYRANURONIC ACIDA,B1ON80.89
BDPBETA-D-GALACTOPYRANURONIC ACIDP2BVK0.89
BDPBETA-D-GALACTOPYRANURONIC ACIDA2JCR0.89
BDPBETA-D-GALACTOPYRANURONIC ACIDA1LXM0.89
BDPBETA-D-GALACTOPYRANURONIC ACIDA1HMW0.89
BDPBETA-D-GALACTOPYRANURONIC ACIDA3HYA0.89
BDPBETA-D-GALACTOPYRANURONIC ACIDA,B1GQL0.89
BDPBETA-D-GALACTOPYRANURONIC ACIDA1OFM0.89
BDPBETA-D-GALACTOPYRANURONIC ACIDA1N7Q0.89
CEG4,6-O-(1-CARBOXYETHYLIDENE)-BETA-
D-GLUCOSE		A1CAP0.74
CEG4,6-O-(1-CARBOXYETHYLIDENE)-BETA-
D-GLUCOSE		A1J0N0.74
GCUD-GLUCURONIC ACIDA1HMW0.89
GCUD-GLUCURONIC ACIDA2JCQ0.89
GCUD-GLUCURONIC ACIDA3HYA0.89
GCUD-GLUCURONIC ACIDA,B2FUQ0.89
GCUD-GLUCURONIC ACIDA1DBG0.89
GCUD-GLUCURONIC ACIDA1FCV0.89
GCUD-GLUCURONIC ACIDA1OFM0.89
GCUD-GLUCURONIC ACIDA,B3E7J0.89
GCUD-GLUCURONIC ACIDA1CB80.89
GCUD-GLUCURONIC ACIDA1HV60.89
GCUD-GLUCURONIC ACIDA1HMU0.89
GCUD-GLUCURONIC ACIDA,B,C3E800.89
GCUD-GLUCURONIC ACIDA,B2VZR0.89
GCUD-GLUCURONIC ACIDA2HYA0.89
GCUD-GLUCURONIC ACIDA1OFL0.89
GCUD-GLUCURONIC ACIDA,B2W870.89
GCUD-GLUCURONIC ACIDA1MQQ0.89
GCUD-GLUCURONIC ACIDA1HM20.89
GCUD-GLUCURONIC ACIDA1HYA0.89
GCUD-GLUCURONIC ACIDA2C4S0.89
GCUD-GLUCURONIC ACIDA4HYA0.89
GCUD-GLUCURONIC ACIDA1C4S0.89
GCUD-GLUCURONIC ACIDA1HM30.89
GCUD-GLUCURONIC ACIDA1DBO0.89
AD0DIGALACTURONIC ACIDA,B2UVF0.83
3LR3,6-dideoxy-L-arabino-hexonic acidA,B3CXO0.74
DR4METHYL 9-(BETA-D-TALOPYRANOSYLOXY)NONANOATEA1ZJO0.72
DR4METHYL 9-(BETA-D-TALOPYRANOSYLOXY)NONANOATEA1ZJP0.72
KDF3-deoxy-alpha-D-erythro-hex-2-ulofuranosonic acidA,B,C2VAR0.83
GU42,3,4,6-TETRA-O-SULFONATO-ALPHA-
D-GLUCOPYRANOSE		H,I1TB60.72
GU42,3,4,6-TETRA-O-SULFONATO-ALPHA-
D-GLUCOPYRANOSE		A,B,D,I2B5T0.72
CS2D-MANNONIC ACIDA,B,C,D2QJM0.73
CS2D-MANNONIC ACIDA,B3DBN0.73
GU52,3-DI-O-METHYL-6-O-SULFONATO-ALPHA-
D-GLUCOPYRANOSE		A,B,D,I2B5T0.72
GU52,3-DI-O-METHYL-6-O-SULFONATO-ALPHA-
D-GLUCOPYRANOSE		H,I1TB60.72
GU02,3,6-TRI-O-SULFONATO-ALPHA-L-GALACTOPYRANOSEA,B,D,I2B5T0.74
GU02,3,6-TRI-O-SULFONATO-ALPHA-L-GALACTOPYRANOSEH,I1TB60.74
IN1PROPIONIC ACID 2,2-DIHYDROXY-3-
(1-GLUCOPYRANOSYLOXY)-METHYLPROPYL ESTER		A,B4OVW0.73
GU22,3-DI-O-METHYL-ALPHA-L-IDOPYRANURONIC ACIDA,B,D,I2B5T0.85
GU22,3-DI-O-METHYL-ALPHA-L-IDOPYRANURONIC ACIDH,I1TB60.85
LFC6-DEOXY-L-GALACTONIC ACIDA2HXU0.72
RSH3-DEOXY-D-LYXO-HEXONIC ACIDA,B,C,D1W3T0.75
IDX2-O-sulfo-alpha-L-gulopyranuronic acid11QQP0.97
SHBmethyl beta-D-galactopyranuronateC,D2NTP0.86
DGS3,6-ANHYDRO-D-GALACTOSE-2-SULFATEA,B1CAR0.72
DGS3,6-ANHYDRO-D-GALACTOSE-2-SULFATEA,B1KTW0.72
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)		A1X1J0.77
FKD2,6-ANHYDRO-3-DEOXY-3-FLUORO-L-
ARABINO-D-GALACTO-NONONIC ACID		A2AGS0.78
GC12,6-ANHYDRO-L-GULONIC ACIDA1HUA0.83
DO83-DEOXY-D-MANNO-2-OCTULOSONATE-
8-PHOSPHATE		A1X6U0.76
G6SD-GALACTOSE-6-SULFATEA1KES0.77
BEMbeta-D-mannuronic acidA2ZAA0.89
BEMbeta-D-mannuronic acidA2ZAC0.89
BEMbeta-D-mannuronic acidA2ZAB0.89
BEMbeta-D-mannuronic acidA1Y3N0.89
BEMbeta-D-mannuronic acidA1Y3P0.89
BEMbeta-D-mannuronic acidA,B1J1N0.89
GKRD-GLUCARATEA3CXT0.75
GKRD-GLUCARATEA,B1JCT0.75
GCOGLUCONIC ACIDB,C,D1BGG0.73
GCOGLUCONIC ACIDA,B1XLF0.73
IDSO2-SULFO-GLUCURONIC ACID11ZBA0.97
IDSO2-SULFO-GLUCURONIC ACIDA2HYV0.97
IDSO2-SULFO-GLUCURONIC ACIDA1BFC0.97
IDSO2-SULFO-GLUCURONIC ACIDA,B,C,D2VRA0.97
IDSO2-SULFO-GLUCURONIC ACIDH,I3B9F0.97
IDSO2-SULFO-GLUCURONIC ACIDB,C,D,E1E0O0.97
IDSO2-SULFO-GLUCURONIC ACIDA2HYU0.97
IDSO2-SULFO-GLUCURONIC ACIDA,B3DY00.97
IDSO2-SULFO-GLUCURONIC ACIDB2AXM0.97
IDSO2-SULFO-GLUCURONIC ACIDA,B1FQ90.97
IDSO2-SULFO-GLUCURONIC ACIDA1BFB0.97
IDSO2-SULFO-GLUCURONIC ACIDA,B1T8U0.97
IDSO2-SULFO-GLUCURONIC ACIDA,B1GMN0.97
IDSO2-SULFO-GLUCURONIC ACIDA1XT30.97
IDSO2-SULFO-GLUCURONIC ACIDA,B,C,D,E,F1AXM0.97
IDSO2-SULFO-GLUCURONIC ACIDA,B,C,D,E,F,
G,H		1GMO0.97
IDSO2-SULFO-GLUCURONIC ACIDA2ERM0.97
IDSO2-SULFO-GLUCURONIC ACIDB,D,F,H1XMN0.97
IDSO2-SULFO-GLUCURONIC ACIDA1HPN0.97
IDSO2-SULFO-GLUCURONIC ACIDA1G5N0.97
IDSO2-SULFO-GLUCURONIC ACID11QQP0.97
IDSO2-SULFO-GLUCURONIC ACIDA,B1RID0.97
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		2DCN0.75
GU12,3-DI-O-METHYL-BETA-D-GLUCOPYRANURONIC ACIDH,I1TB60.85
GU12,3-DI-O-METHYL-BETA-D-GLUCOPYRANURONIC ACIDA,B,D,I2B5T0.85
LGC(3S,4R,5R,6S)-3,4,5-TRIHYDROXY-
6-(HYDROXYMETHYL)TETRAHYDRO-2H-
PYRAN-2-ONE		M1E6X0.81
LGC(3S,4R,5R,6S)-3,4,5-TRIHYDROXY-
6-(HYDROXYMETHYL)TETRAHYDRO-2H-
PYRAN-2-ONE		A,B2E400.81
LGC(3S,4R,5R,6S)-3,4,5-TRIHYDROXY-
6-(HYDROXYMETHYL)TETRAHYDRO-2H-
PYRAN-2-ONE		A2VWG0.81
LGC(3S,4R,5R,6S)-3,4,5-TRIHYDROXY-
6-(HYDROXYMETHYL)TETRAHYDRO-2H-
PYRAN-2-ONE		A,B3EQO0.81
M8CMETHYL ALPHA-D-GALACTOPYRANURONATEC,D2NST0.86
M8CMETHYL ALPHA-D-GALACTOPYRANURONATEC,D2NSP0.86
M8CMETHYL ALPHA-D-GALACTOPYRANURONATEC,D2NT90.86
M8CMETHYL ALPHA-D-GALACTOPYRANURONATEC,D2NTQ0.86
M8CMETHYL ALPHA-D-GALACTOPYRANURONATEC,D2NTP0.86
M8CMETHYL ALPHA-D-GALACTOPYRANURONATEC,D2NT60.86
DXG4-DEOXYGLUCARATEA,B,C,D1ECQ0.73
NT22,3,4,6-TETRA-O-SULFOHEXOPYRANOSEA,C1SR50.73
GCV4-O-METHYL-ALPHA-D-GLUCURONIC ACIDA1K9E0.88
GCV4-O-METHYL-ALPHA-D-GLUCURONIC ACIDA,B1V6X0.88
GCV4-O-METHYL-ALPHA-D-GLUCURONIC ACIDA1UQZ0.88
GCV4-O-METHYL-ALPHA-D-GLUCURONIC ACIDA,B1H410.88
GCV4-O-METHYL-ALPHA-D-GLUCURONIC ACIDA1K9F0.88
GCV4-O-METHYL-ALPHA-D-GLUCURONIC ACIDA,B1V6W0.88
DG04-O-alpha-D-galactopyranuronosyl-
alpha-D-galactopyranuronic acid		A3DYB0.83
GCW4-O-METHYL-BETA-D-GLUCURONIC ACIDA1L8N0.88
CDGMETHYL 4,6-O-[(1R)-1-CARBOXYETHYLIDENE]-
BETA-D-GALACTOPYRANOSIDE		A,B,C,D,E1GYK0.73
GC44-DEOXY-D-GLUCURONIC ACIDA1I8Q0.92
GC44-DEOXY-D-GLUCURONIC ACIDA1C4S0.92
GC44-DEOXY-D-GLUCURONIC ACIDA1DBO0.92
TGUTRIGALACTURONIC ACIDA2V8K0.78
LGUALPHA-L-GULURONATEA2ZAC0.89
LGUALPHA-L-GULURONATEA2ZAA0.89
LGUALPHA-L-GULURONATEA,B2QJR0.89
LGUALPHA-L-GULURONATEA2ZAB0.89
LGUALPHA-L-GULURONATEA,B1J1N0.89
LGUALPHA-L-GULURONATEA1Y3P0.89
LGTL-GLUCARIC ACIDA,B,C,D3CB30.75
LGTL-GLUCARIC ACIDA,B,C2PP30.75
SGAO3-SULFONYLGALACTOSE1,2,33KMB0.77
SGAO3-SULFONYLGALACTOSEA,B,C,D1WW50.77
SGAO3-SULFONYLGALACTOSEA2ZFE0.77
SGAO3-SULFONYLGALACTOSEA,B,C1BRR0.77
SGAO3-SULFONYLGALACTOSEA1FWU0.77
SGAO3-SULFONYLGALACTOSEA1FWV0.77
ADAALPHA-D-GALACTOPYRANURONIC ACIDC,D2NST0.89
ADAALPHA-D-GALACTOPYRANURONIC ACIDA1GXO0.89
ADAALPHA-D-GALACTOPYRANURONIC ACIDA2EWE0.89
ADAALPHA-D-GALACTOPYRANURONIC ACIDA2UVH0.89
ADAALPHA-D-GALACTOPYRANURONIC ACIDA2O040.89
ADAALPHA-D-GALACTOPYRANURONIC ACIDC,D2NTB0.89
ADAALPHA-D-GALACTOPYRANURONIC ACIDC,D2NT90.89
ADAALPHA-D-GALACTOPYRANURONIC ACIDA2NZM0.89
ADAALPHA-D-GALACTOPYRANURONIC ACIDA,B2Z8S0.89
ADAALPHA-D-GALACTOPYRANURONIC ACIDA2UVJ0.89
ADAALPHA-D-GALACTOPYRANURONIC ACIDA2O0V0.89
ADAALPHA-D-GALACTOPYRANURONIC ACIDC,D2NSP0.89
ADAALPHA-D-GALACTOPYRANURONIC ACIDA,B3B8Y0.89
ADAALPHA-D-GALACTOPYRANURONIC ACIDC,D2NT60.89
ADAALPHA-D-GALACTOPYRANURONIC ACIDA2O170.89
ADAALPHA-D-GALACTOPYRANURONIC ACIDC,D2NTP0.89
ADAALPHA-D-GALACTOPYRANURONIC ACIDA2O1D0.89
ADAALPHA-D-GALACTOPYRANURONIC ACIDC,D2NTQ0.89
KBG2-KETO-BETA-D-GLUCOSEA2F5V0.81
KBG2-KETO-BETA-D-GLUCOSEA1FQ70.81
KDA(3-DEOXY-D-MANNO-OCT-2-ULOSONIC ACID)-
2-O-ALLYL		A,B2R1X0.71
KDA(3-DEOXY-D-MANNO-OCT-2-ULOSONIC ACID)-
2-O-ALLYL		A,B2R2B0.71
KDA(3-DEOXY-D-MANNO-OCT-2-ULOSONIC ACID)-
2-O-ALLYL		A,B1Q9Q0.71
KDA(3-DEOXY-D-MANNO-OCT-2-ULOSONIC ACID)-
2-O-ALLYL		A,B2R230.71
KDA(3-DEOXY-D-MANNO-OCT-2-ULOSONIC ACID)-
2-O-ALLYL		A,B1Q9T0.71
KDA(3-DEOXY-D-MANNO-OCT-2-ULOSONIC ACID)-
2-O-ALLYL		A,B3BPC0.71
KDA(3-DEOXY-D-MANNO-OCT-2-ULOSONIC ACID)-
2-O-ALLYL		A,B1Q9R0.71
KDA(3-DEOXY-D-MANNO-OCT-2-ULOSONIC ACID)-
2-O-ALLYL		A,B2R1W0.71
149D-GALCTOPYRANOSYL-1-ONA,B,C,D1JZ50.81
149D-GALCTOPYRANOSYL-1-ONA,B,C,D3CZJ0.81
KDEprop-2-en-1-yl 3-deoxy-beta-L-gulo-
oct-2-ulopyranosidonic acid		A2R2E0.71
2GL4-O-ACETYL-2,6-DIDEOXY-ALPHA-D-
GALACTO-HEXOPYRANOSE		A,B1EKH0.73
2GL4-O-ACETYL-2,6-DIDEOXY-ALPHA-D-
GALACTO-HEXOPYRANOSE		A,B1EKI0.73
IDRL-IDURONIC ACIDA2V380.89
IDRL-IDURONIC ACIDA1HM20.89
IDRL-IDURONIC ACIDA2ERM0.89
MAVD-MANNURONIC ACIDA,B1J1N0.89
MAVD-MANNURONIC ACIDA1Y3P0.89
MAVD-MANNURONIC ACIDA,B,D2PYH0.89
MAVD-MANNURONIC ACIDA1Y3N0.89
MAVD-MANNURONIC ACIDA1HV60.89
KDG2-KETO-3-DEOXYGLUCONATEA,B1V1A0.72
KDG2-KETO-3-DEOXYGLUCONATEA,B,C2VAR0.72
KDG2-KETO-3-DEOXYGLUCONATEA,B,C,D2QJN0.72
NTPHEPARIN PENTASACCHARIDEI,L1NQ90.72
NTPHEPARIN PENTASACCHARIDEI,L1AZX0.72
NTPHEPARIN PENTASACCHARIDEI,L1E030.72
KO1D-glycero-alpha-D-talo-oct-2-ulopyranosonic acidA,B2R230.81
GCT4,5-DIHYDROXY-TETRAHYDRO-PYRAN-
2-CARBOXYLIC ACID		A1RWG0.85
GCT4,5-DIHYDROXY-TETRAHYDRO-PYRAN-
2-CARBOXYLIC ACID		A1RWF0.85
GCT4,5-DIHYDROXY-TETRAHYDRO-PYRAN-
2-CARBOXYLIC ACID		A1RWH0.85
G4S4-O-sulfo-beta-D-galactopyranose1,2,34KMB0.77
G4S4-O-sulfo-beta-D-galactopyranoseA,B1CAR0.77
G4S4-O-sulfo-beta-D-galactopyranoseA,B1KTW0.77
KDO3-DEOXY-D-MANNO-OCT-2-ULOSONIC ACIDA,B,C1Q9W0.83
KDO3-DEOXY-D-MANNO-OCT-2-ULOSONIC ACIDA,B3DUV0.83
KDO3-DEOXY-D-MANNO-OCT-2-ULOSONIC ACIDA,B,C,D3DUS0.83
KDO3-DEOXY-D-MANNO-OCT-2-ULOSONIC ACIDA1QJQ0.83
KDO3-DEOXY-D-MANNO-OCT-2-ULOSONIC ACIDA,B1Q9R0.83
KDO3-DEOXY-D-MANNO-OCT-2-ULOSONIC ACIDA1QFF0.83
KDO3-DEOXY-D-MANNO-OCT-2-ULOSONIC ACIDA2FCP0.83
KDO3-DEOXY-D-MANNO-OCT-2-ULOSONIC ACIDA,B1Q9Q0.83
KDO3-DEOXY-D-MANNO-OCT-2-ULOSONIC ACIDA,B3DV40.83
KDO3-DEOXY-D-MANNO-OCT-2-ULOSONIC ACIDA,B,C,D3FXI0.83
KDO3-DEOXY-D-MANNO-OCT-2-ULOSONIC ACIDA,B2R2B0.83
KDO3-DEOXY-D-MANNO-OCT-2-ULOSONIC ACIDA1FCP0.83
KDO3-DEOXY-D-MANNO-OCT-2-ULOSONIC ACIDA1FI10.83
KDO3-DEOXY-D-MANNO-OCT-2-ULOSONIC ACIDA,B,C,D3DUU0.83
KDO3-DEOXY-D-MANNO-OCT-2-ULOSONIC ACIDA,B1Q9V0.83
KDO3-DEOXY-D-MANNO-OCT-2-ULOSONIC ACIDA1QFG0.83
KDO3-DEOXY-D-MANNO-OCT-2-ULOSONIC ACIDA1QKC0.83
KDO3-DEOXY-D-MANNO-OCT-2-ULOSONIC ACIDA,B,C,D3DUR0.83
KDO3-DEOXY-D-MANNO-OCT-2-ULOSONIC ACIDA,B2R1Y0.83
KDO3-DEOXY-D-MANNO-OCT-2-ULOSONIC ACIDA,B1Q9T0.83
KDO3-DEOXY-D-MANNO-OCT-2-ULOSONIC ACIDA,B3DV60.83
KDO3-DEOXY-D-MANNO-OCT-2-ULOSONIC ACIDA,B2GRX0.83
46M(4AR,6R,7S,8R,8AS)-HEXAHYDRO-6,7,8-
TRIHYDROXY-2-METHYLPYRANO[3,2-D][1,3]DIOXINE-
2-CARBOXYLIC ACID		A1X1I0.74
GU3methyl 3-O-methyl-2,6-di-O-sulfo-
alpha-D-glucopyranoside		H,I1TB60.7
GU3methyl 3-O-methyl-2,6-di-O-sulfo-
alpha-D-glucopyranoside		A,B,D,I2B5T0.7
GTRGALACTURONIC ACIDA1KCD0.89
GTRGALACTURONIC ACIDA1KCC0.89
GTRGALACTURONIC ACIDA1N7Q0.89
SSH3-DEOXY-D-ARABINO-HEXONIC ACIDA,B,C,D1W3N0.75
PDX2,3-DI-O-SULFO-ALPHA-D-GLUCOPYRANOSEA,B1O750.76
GU62,3,6-TRI-O-SULFONATO-ALPHA-D-GLUCOPYRANOSEH,I1TB60.74
GU62,3,6-TRI-O-SULFONATO-ALPHA-D-GLUCOPYRANOSEA,B,D,I2B5T0.74
IDU2-O-sulfo-beta-L-altropyranuronic acidA,B2BRS0.97
IDU2-O-sulfo-beta-L-altropyranuronic acidA,B1FQ90.97