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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03417741

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
GCV4-O-METHYL-ALPHA-D-GLUCURONIC ACIDA1K9E0.7
GCV4-O-METHYL-ALPHA-D-GLUCURONIC ACIDA,B1V6X0.7
GCV4-O-METHYL-ALPHA-D-GLUCURONIC ACIDA1UQZ0.7
GCV4-O-METHYL-ALPHA-D-GLUCURONIC ACIDA,B1H410.7
GCV4-O-METHYL-ALPHA-D-GLUCURONIC ACIDA1K9F0.7
GCV4-O-METHYL-ALPHA-D-GLUCURONIC ACIDA,B1V6W0.7
GCW4-O-METHYL-BETA-D-GLUCURONIC ACIDA1L8N0.7
M8CMETHYL ALPHA-D-GALACTOPYRANURONATEC,D2NST0.71
M8CMETHYL ALPHA-D-GALACTOPYRANURONATEC,D2NSP0.71
M8CMETHYL ALPHA-D-GALACTOPYRANURONATEC,D2NT90.71
M8CMETHYL ALPHA-D-GALACTOPYRANURONATEC,D2NTQ0.71
M8CMETHYL ALPHA-D-GALACTOPYRANURONATEC,D2NTP0.71
M8CMETHYL ALPHA-D-GALACTOPYRANURONATEC,D2NT60.71
KDA(3-DEOXY-D-MANNO-OCT-2-ULOSONIC ACID)-
2-O-ALLYL		A,B2R1X1
KDA(3-DEOXY-D-MANNO-OCT-2-ULOSONIC ACID)-
2-O-ALLYL		A,B2R2B1
KDA(3-DEOXY-D-MANNO-OCT-2-ULOSONIC ACID)-
2-O-ALLYL		A,B1Q9Q1
KDA(3-DEOXY-D-MANNO-OCT-2-ULOSONIC ACID)-
2-O-ALLYL		A,B2R231
KDA(3-DEOXY-D-MANNO-OCT-2-ULOSONIC ACID)-
2-O-ALLYL		A,B1Q9T1
KDA(3-DEOXY-D-MANNO-OCT-2-ULOSONIC ACID)-
2-O-ALLYL		A,B3BPC1
KDA(3-DEOXY-D-MANNO-OCT-2-ULOSONIC ACID)-
2-O-ALLYL		A,B1Q9R1
KDA(3-DEOXY-D-MANNO-OCT-2-ULOSONIC ACID)-
2-O-ALLYL		A,B2R1W1
MAVD-MANNURONIC ACIDA,B1J1N0.71
MAVD-MANNURONIC ACIDA1Y3P0.71
MAVD-MANNURONIC ACIDA,B,D2PYH0.71
MAVD-MANNURONIC ACIDA1Y3N0.71
MAVD-MANNURONIC ACIDA1HV60.71
KDEprop-2-en-1-yl 3-deoxy-beta-L-gulo-
oct-2-ulopyranosidonic acid		A2R2E1
IDRL-IDURONIC ACIDA2V380.71
IDRL-IDURONIC ACIDA1HM20.71
IDRL-IDURONIC ACIDA2ERM0.71
DGDDIGALACTOSYL DIACYL GLYCEROL (DGDG)A2C9E0.71
DGDDIGALACTOSYL DIACYL GLYCEROL (DGDG)M,N,O1PPR0.71
DGDDIGALACTOSYL DIACYL GLYCEROL (DGDG)A,B,C,D,E,F,
H,I,J,K,L,M,
O,T,V,X,Z		3BZ20.71
DGDDIGALACTOSYL DIACYL GLYCEROL (DGDG)A,B,C2BHW0.71
DGDDIGALACTOSYL DIACYL GLYCEROL (DGDG)A,B,C,D,E,F,
G,H,I,J		1RWT0.71
DGDDIGALACTOSYL DIACYL GLYCEROL (DGDG)A,B,C,D,E,F,
H,I,J,K,M,O,
T,V,Z		3BZ10.71
DGDDIGALACTOSYL DIACYL GLYCEROL (DGDG)A,B,C,D,F,H,
K,L,T,V,Z		3A0H0.71
DGDDIGALACTOSYL DIACYL GLYCEROL (DGDG)A,B,C,D,F,H,
I,K,L,M,T,V,X		2AXT0.71
DGDDIGALACTOSYL DIACYL GLYCEROL (DGDG)A,B,C,D,E,H,
J,K,L,T,V,Z		3A0B0.71
GTRGALACTURONIC ACIDA1KCD0.71
GTRGALACTURONIC ACIDA1KCC0.71
GTRGALACTURONIC ACIDA1N7Q0.71
KDRprop-2-en-1-yl 3-deoxy-alpha-D-
manno-octos-2-ulopyranoside		A,B2R1Y0.93
GU22,3-DI-O-METHYL-ALPHA-L-IDOPYRANURONIC ACIDA,B,D,I2B5T0.73
GU22,3-DI-O-METHYL-ALPHA-L-IDOPYRANURONIC ACIDH,I1TB60.73
291prop-2-en-1-yl 7-O-carbamoyl-L-
glycero-alpha-D-manno-heptopyranoside		A,B,C2RID0.72
FKD2,6-ANHYDRO-3-DEOXY-3-FLUORO-L-
ARABINO-D-GALACTO-NONONIC ACID		A2AGS0.78
AD0DIGALACTURONIC ACIDA,B2UVF0.76
20SBETA-D-FRUCTOFURANOSYL 6-O-OCTANOYL-
ALPHA-D-GLUCOPYRANOSIDE		A,B2FAF0.72
20SBETA-D-FRUCTOFURANOSYL 6-O-OCTANOYL-
ALPHA-D-GLUCOPYRANOSIDE		A,B,C,D2FAH0.72
20SBETA-D-FRUCTOFURANOSYL 6-O-OCTANOYL-
ALPHA-D-GLUCOPYRANOSIDE		A,B2QZY0.72
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,B2FCT0.72
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,B2FCV0.72
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,B2FCU0.72
LGUALPHA-L-GULURONATEA2ZAC0.71
LGUALPHA-L-GULURONATEA2ZAA0.71
LGUALPHA-L-GULURONATEA,B2QJR0.71
LGUALPHA-L-GULURONATEA2ZAB0.71
LGUALPHA-L-GULURONATEA,B1J1N0.71
LGUALPHA-L-GULURONATEA1Y3P0.71
GU12,3-DI-O-METHYL-BETA-D-GLUCOPYRANURONIC ACIDH,I1TB60.73
GU12,3-DI-O-METHYL-BETA-D-GLUCOPYRANURONIC ACIDA,B,D,I2B5T0.73
DR4METHYL 9-(BETA-D-TALOPYRANOSYLOXY)NONANOATEA1ZJO0.75
DR4METHYL 9-(BETA-D-TALOPYRANOSYLOXY)NONANOATEA1ZJP0.75
ADAALPHA-D-GALACTOPYRANURONIC ACIDC,D2NST0.71
ADAALPHA-D-GALACTOPYRANURONIC ACIDA1GXO0.71
ADAALPHA-D-GALACTOPYRANURONIC ACIDA2EWE0.71
ADAALPHA-D-GALACTOPYRANURONIC ACIDA2UVH0.71
ADAALPHA-D-GALACTOPYRANURONIC ACIDA2O040.71
ADAALPHA-D-GALACTOPYRANURONIC ACIDC,D2NTB0.71
ADAALPHA-D-GALACTOPYRANURONIC ACIDC,D2NT90.71
ADAALPHA-D-GALACTOPYRANURONIC ACIDA2NZM0.71
ADAALPHA-D-GALACTOPYRANURONIC ACIDA,B2Z8S0.71
ADAALPHA-D-GALACTOPYRANURONIC ACIDA2UVJ0.71
ADAALPHA-D-GALACTOPYRANURONIC ACIDA2O0V0.71
ADAALPHA-D-GALACTOPYRANURONIC ACIDC,D2NSP0.71
ADAALPHA-D-GALACTOPYRANURONIC ACIDA,B3B8Y0.71
ADAALPHA-D-GALACTOPYRANURONIC ACIDC,D2NT60.71
ADAALPHA-D-GALACTOPYRANURONIC ACIDA2O170.71
ADAALPHA-D-GALACTOPYRANURONIC ACIDC,D2NTP0.71
ADAALPHA-D-GALACTOPYRANURONIC ACIDA2O1D0.71
ADAALPHA-D-GALACTOPYRANURONIC ACIDC,D2NTQ0.71
GCT4,5-DIHYDROXY-TETRAHYDRO-PYRAN-
2-CARBOXYLIC ACID		A1RWG0.72
GCT4,5-DIHYDROXY-TETRAHYDRO-PYRAN-
2-CARBOXYLIC ACID		A1RWF0.72
GCT4,5-DIHYDROXY-TETRAHYDRO-PYRAN-
2-CARBOXYLIC ACID		A1RWH0.72
GC12,6-ANHYDRO-L-GULONIC ACIDA1HUA0.7
TGUTRIGALACTURONIC ACIDA2V8K0.72
AB03,7:6,10:9,14-TRIANHYDRO-2,5,11,12,13-
PENTADEOXY-4-O-(METHOXYMETHYL)-
L-ARABINO-L-ALLO-TETRADEC-12-ENONIC ACID		H,L2E270.74
GC44-DEOXY-D-GLUCURONIC ACIDA1I8Q0.73
GC44-DEOXY-D-GLUCURONIC ACIDA1C4S0.73
GC44-DEOXY-D-GLUCURONIC ACIDA1DBO0.73
GGDNONADEC-10-ENOIC ACID 2-[3,4-DIHYDROXY-
6-HYDROXYMETHYL-5-(3,4,5-TRIHYDROXY-
6-HYDROXYMETHYL-TETRAHYDRO-PYRAN-
2-YLOXY)-TETRAHYDRO-PYRAN-2-YLOXY]-
1-OCTADEC-9-ENOYLOXYMETHYL-ETHYL ESTER		H,L,M2J8C0.73
GGDNONADEC-10-ENOIC ACID 2-[3,4-DIHYDROXY-
6-HYDROXYMETHYL-5-(3,4,5-TRIHYDROXY-
6-HYDROXYMETHYL-TETRAHYDRO-PYRAN-
2-YLOXY)-TETRAHYDRO-PYRAN-2-YLOXY]-
1-OCTADEC-9-ENOYLOXYMETHYL-ETHYL ESTER		L,M1M3X0.73
LMG1,2-DISTEAROYL-MONOGALACTOSYL-DIGLYCERIDEA,B,C,F,I,J,
K,L,M,X		1JB00.73
LMG1,2-DISTEAROYL-MONOGALACTOSYL-DIGLYCERIDEA,B,C,D,E,F,
H,I,J,K,M,O,
T,V,Z		3BZ10.73
LMG1,2-DISTEAROYL-MONOGALACTOSYL-DIGLYCERIDEA,B,C,D,L,R1Q900.73
LMG1,2-DISTEAROYL-MONOGALACTOSYL-DIGLYCERIDEA,B,C,D,E,F,
H,I,J,K,L,M,
O,T,V,X,Z		3BZ20.73
2OS3-N-OCTANOYLSUCROSEA,B1T3I0.72
BEMbeta-D-mannuronic acidA2ZAA0.71
BEMbeta-D-mannuronic acidA2ZAC0.71
BEMbeta-D-mannuronic acidA2ZAB0.71
BEMbeta-D-mannuronic acidA1Y3N0.71
BEMbeta-D-mannuronic acidA1Y3P0.71
BEMbeta-D-mannuronic acidA,B1J1N0.71
KO2prop-2-en-1-yl D-glycero-alpha-
D-talo-oct-2-ulopyranosidonic acid		A,B2R2H0.97
BDPBETA-D-GALACTOPYRANURONIC ACIDA1N7R0.71
BDPBETA-D-GALACTOPYRANURONIC ACIDA3C9E0.71
BDPBETA-D-GALACTOPYRANURONIC ACIDA1LOH0.71
BDPBETA-D-GALACTOPYRANURONIC ACIDA1CAP0.71
BDPBETA-D-GALACTOPYRANURONIC ACIDA1HM30.71
BDPBETA-D-GALACTOPYRANURONIC ACIDA1HUA0.71
BDPBETA-D-GALACTOPYRANURONIC ACIDA1LXK0.71
BDPBETA-D-GALACTOPYRANURONIC ACIDA,B1GQK0.71
BDPBETA-D-GALACTOPYRANURONIC ACIDA,B1ON80.71
BDPBETA-D-GALACTOPYRANURONIC ACIDP2BVK0.71
BDPBETA-D-GALACTOPYRANURONIC ACIDA2JCR0.71
BDPBETA-D-GALACTOPYRANURONIC ACIDA1LXM0.71
BDPBETA-D-GALACTOPYRANURONIC ACIDA1HMW0.71
BDPBETA-D-GALACTOPYRANURONIC ACIDA3HYA0.71
BDPBETA-D-GALACTOPYRANURONIC ACIDA,B1GQL0.71
BDPBETA-D-GALACTOPYRANURONIC ACIDA1OFM0.71
BDPBETA-D-GALACTOPYRANURONIC ACIDA1N7Q0.71
GCUD-GLUCURONIC ACIDA1HMW0.71
GCUD-GLUCURONIC ACIDA2JCQ0.71
GCUD-GLUCURONIC ACIDA3HYA0.71
GCUD-GLUCURONIC ACIDA,B2FUQ0.71
GCUD-GLUCURONIC ACIDA1DBG0.71
GCUD-GLUCURONIC ACIDA1FCV0.71
GCUD-GLUCURONIC ACIDA1OFM0.71
GCUD-GLUCURONIC ACIDA,B3E7J0.71
GCUD-GLUCURONIC ACIDA1CB80.71
GCUD-GLUCURONIC ACIDA1HV60.71
GCUD-GLUCURONIC ACIDA1HMU0.71
GCUD-GLUCURONIC ACIDA,B,C3E800.71
GCUD-GLUCURONIC ACIDA,B2VZR0.71
GCUD-GLUCURONIC ACIDA2HYA0.71
GCUD-GLUCURONIC ACIDA1OFL0.71
GCUD-GLUCURONIC ACIDA,B2W870.71
GCUD-GLUCURONIC ACIDA1MQQ0.71
GCUD-GLUCURONIC ACIDA1HM20.71
GCUD-GLUCURONIC ACIDA1HYA0.71
GCUD-GLUCURONIC ACIDA2C4S0.71
GCUD-GLUCURONIC ACIDA4HYA0.71
GCUD-GLUCURONIC ACIDA1C4S0.71
GCUD-GLUCURONIC ACIDA1HM30.71
GCUD-GLUCURONIC ACIDA1DBO0.71
DO83-DEOXY-D-MANNO-2-OCTULOSONATE-
8-PHOSPHATE		A1X6U0.77
SHBmethyl beta-D-galactopyranuronateC,D2NTP0.71
KO1D-glycero-alpha-D-talo-oct-2-ulopyranosonic acidA,B2R230.81
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
OSUN-OCTANOYLSUCROSEA1PYY0.72
KDF3-deoxy-alpha-D-erythro-hex-2-ulofuranosonic acidA,B,C2VAR0.7
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)		A1X1J0.71
MGE(1S)-2-(ALPHA-L-ALLOPYRANOSYLOXY)-
1-[(TRIDECANOYLOXY)METHYL]ETHYL PALMITATE		A,B,C,D,F,H,
K,L,T,V,Z		3A0H0.73
MGE(1S)-2-(ALPHA-L-ALLOPYRANOSYLOXY)-
1-[(TRIDECANOYLOXY)METHYL]ETHYL PALMITATE		A,B,C,D,F,H,
I,K,L,M,T,V,X		2AXT0.73
MGE(1S)-2-(ALPHA-L-ALLOPYRANOSYLOXY)-
1-[(TRIDECANOYLOXY)METHYL]ETHYL PALMITATE		A,B,C,D,E,H,
J,K,L,T,V,Z		3A0B0.73
DG04-O-alpha-D-galactopyranuronosyl-
alpha-D-galactopyranuronic acid		A3DYB0.76