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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03078659

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
GC12,6-ANHYDRO-L-GULONIC ACIDA1HUA0.76
BEMbeta-D-mannuronic acidA2ZAA0.72
BEMbeta-D-mannuronic acidA2ZAC0.72
BEMbeta-D-mannuronic acidA2ZAB0.72
BEMbeta-D-mannuronic acidA1Y3N0.72
BEMbeta-D-mannuronic acidA1Y3P0.72
BEMbeta-D-mannuronic acidA,B1J1N0.72
AOSD-ALLOSEA,B,C,D2I570.76
KDP2-KETO-DEOXY-GALACTOSEA2V820.98
GLR2,3-DIHYDROXY-5-OXO-HEXANEDIOATEA,B,C,D1EC80.81
GLR2,3-DIHYDROXY-5-OXO-HEXANEDIOATEA,B,C,D1JDF0.81
KD03-deoxy-8-O-phosphono-D-manno-oct-
2-ulosonic acid		A,B3E120.9
149D-GALCTOPYRANOSYL-1-ONA,B,C,D1JZ50.77
149D-GALCTOPYRANOSYL-1-ONA,B,C,D3CZJ0.77
R105-O-phosphono-D-ribonic acidA,B,C,D,E2VVQ0.88
LGC(3S,4R,5R,6S)-3,4,5-TRIHYDROXY-
6-(HYDROXYMETHYL)TETRAHYDRO-2H-
PYRAN-2-ONE		M1E6X0.77
LGC(3S,4R,5R,6S)-3,4,5-TRIHYDROXY-
6-(HYDROXYMETHYL)TETRAHYDRO-2H-
PYRAN-2-ONE		A,B2E400.77
LGC(3S,4R,5R,6S)-3,4,5-TRIHYDROXY-
6-(HYDROXYMETHYL)TETRAHYDRO-2H-
PYRAN-2-ONE		A2VWG0.77
LGC(3S,4R,5R,6S)-3,4,5-TRIHYDROXY-
6-(HYDROXYMETHYL)TETRAHYDRO-2H-
PYRAN-2-ONE		A,B3EQO0.77
DNOD-mannoseA3BDK0.76
SSH3-DEOXY-D-ARABINO-HEXONIC ACIDA,B,C,D1W3N0.81
GKRD-GLUCARATEA3CXT0.86
GKRD-GLUCARATEA,B1JCT0.86
DQA1,3,4-TRIHYDROXY-5-OXO-CYCLOHEXANECARBOXYLIC ACIDA1J2Y0.71
1NT(2R,4R,5R,6R,7R)-2,4,5,6,7-PENTAHYDROXY-
2,8-BIS(PHOSPHONOOXY)OCTANOIC ACID		A,B2NXG0.83
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		2NX30.83
DXP1-DEOXY-D-XYLULOSE-5-PHOSPHATEB,C,D,E,F,G,H3GK00.74
DXP1-DEOXY-D-XYLULOSE-5-PHOSPHATEA,B,C,E,F,G1M5W0.74
DXP1-DEOXY-D-XYLULOSE-5-PHOSPHATEA,B,C,D1IXN0.74
DXP1-DEOXY-D-XYLULOSE-5-PHOSPHATEA,B1Q0Q0.74
CS2D-MANNONIC ACIDA,B,C,D2QJM0.84
CS2D-MANNONIC ACIDA,B3DBN0.84
HMS5-O-phosphono-L-ribuloseA,B1XBX0.81
TAGD-tagatoseA,B,C,D2QUM0.77
RNSL-RHAMNOSEA,B,C,D1X8D0.7
RNSL-RHAMNOSEA,B,C,D1DE60.7
RNSL-RHAMNOSEA,B,C,D2I560.7
3MF3-O-METHYLFRUCTOSE IN LINEAR FORMA,B1XYC0.72
I22D-ALTRO-HEPT-2-ULOSE 7-PHOSPHATEB2I220.9
FUDD-fructoseA,B,C,D2QUN0.77
GCOGLUCONIC ACIDB,C,D1BGG0.84
GCOGLUCONIC ACIDA,B1XLF0.84
DO83-DEOXY-D-MANNO-2-OCTULOSONATE-
8-PHOSPHATE		A1X6U0.76
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
DERD-4-PHOSPHOERYTHRONIC ACIDA,B,C,D1LK70.79
DERD-4-PHOSPHOERYTHRONIC ACIDA,B2CXO0.79
GCUD-GLUCURONIC ACIDA1HMW0.72
GCUD-GLUCURONIC ACIDA2JCQ0.72
GCUD-GLUCURONIC ACIDA3HYA0.72
GCUD-GLUCURONIC ACIDA,B2FUQ0.72
GCUD-GLUCURONIC ACIDA1DBG0.72
GCUD-GLUCURONIC ACIDA1FCV0.72
GCUD-GLUCURONIC ACIDA1OFM0.72
GCUD-GLUCURONIC ACIDA,B3E7J0.72
GCUD-GLUCURONIC ACIDA1CB80.72
GCUD-GLUCURONIC ACIDA1HV60.72
GCUD-GLUCURONIC ACIDA1HMU0.72
GCUD-GLUCURONIC ACIDA,B,C3E800.72
GCUD-GLUCURONIC ACIDA,B2VZR0.72
GCUD-GLUCURONIC ACIDA2HYA0.72
GCUD-GLUCURONIC ACIDA1OFL0.72
GCUD-GLUCURONIC ACIDA,B2W870.72
GCUD-GLUCURONIC ACIDA1MQQ0.72
GCUD-GLUCURONIC ACIDA1HM20.72
GCUD-GLUCURONIC ACIDA1HYA0.72
GCUD-GLUCURONIC ACIDA2C4S0.72
GCUD-GLUCURONIC ACIDA4HYA0.72
GCUD-GLUCURONIC ACIDA1C4S0.72
GCUD-GLUCURONIC ACIDA1HM30.72
GCUD-GLUCURONIC ACIDA1DBO0.72
BDPBETA-D-GALACTOPYRANURONIC ACIDA1N7R0.72
BDPBETA-D-GALACTOPYRANURONIC ACIDA3C9E0.72
BDPBETA-D-GALACTOPYRANURONIC ACIDA1LOH0.72
BDPBETA-D-GALACTOPYRANURONIC ACIDA1CAP0.72
BDPBETA-D-GALACTOPYRANURONIC ACIDA1HM30.72
BDPBETA-D-GALACTOPYRANURONIC ACIDA1HUA0.72
BDPBETA-D-GALACTOPYRANURONIC ACIDA1LXK0.72
BDPBETA-D-GALACTOPYRANURONIC ACIDA,B1GQK0.72
BDPBETA-D-GALACTOPYRANURONIC ACIDA,B1ON80.72
BDPBETA-D-GALACTOPYRANURONIC ACIDP2BVK0.72
BDPBETA-D-GALACTOPYRANURONIC ACIDA2JCR0.72
BDPBETA-D-GALACTOPYRANURONIC ACIDA1LXM0.72
BDPBETA-D-GALACTOPYRANURONIC ACIDA1HMW0.72
BDPBETA-D-GALACTOPYRANURONIC ACIDA3HYA0.72
BDPBETA-D-GALACTOPYRANURONIC ACIDA,B1GQL0.72
BDPBETA-D-GALACTOPYRANURONIC ACIDA1OFM0.72
BDPBETA-D-GALACTOPYRANURONIC ACIDA1N7Q0.72
KDF3-deoxy-alpha-D-erythro-hex-2-ulofuranosonic acidA,B,C2VAR0.71
P6F1,6-di-O-phosphono-D-fructoseA,B3GB60.88
KO1D-glycero-alpha-D-talo-oct-2-ulopyranosonic acidA,B2R230.7
5RPRIBULOSE-5-PHOSPHATEA,B1XBY0.81
5RPRIBULOSE-5-PHOSPHATEA,B1XBX0.81
5RPRIBULOSE-5-PHOSPHATEA1UJ50.81
5RPRIBULOSE-5-PHOSPHATEA,B1PVY0.81
5RPRIBULOSE-5-PHOSPHATEA2RIU0.81
5RPRIBULOSE-5-PHOSPHATEA,B1SNN0.81
5RPRIBULOSE-5-PHOSPHATEA,B1TKU0.81
5RPRIBULOSE-5-PHOSPHATEA,B3HHE0.81
5RPRIBULOSE-5-PHOSPHATEA,B1XBV0.81
5RPRIBULOSE-5-PHOSPHATEA,B,C2ISS0.81
5RPRIBULOSE-5-PHOSPHATEA,B,C2IYP0.81
5RPRIBULOSE-5-PHOSPHATEA,B,C,D,E2VVP0.81
GCV4-O-METHYL-ALPHA-D-GLUCURONIC ACIDA1K9E0.71
GCV4-O-METHYL-ALPHA-D-GLUCURONIC ACIDA,B1V6X0.71
GCV4-O-METHYL-ALPHA-D-GLUCURONIC ACIDA1UQZ0.71
GCV4-O-METHYL-ALPHA-D-GLUCURONIC ACIDA,B1H410.71
GCV4-O-METHYL-ALPHA-D-GLUCURONIC ACIDA1K9F0.71
GCV4-O-METHYL-ALPHA-D-GLUCURONIC ACIDA,B1V6W0.71
6PG6-PHOSPHOGLUCONIC ACIDA1PGP0.96
6PG6-PHOSPHOGLUCONIC ACIDA,B1J3R0.96
6PG6-PHOSPHOGLUCONIC ACIDA,B1QY40.96
6PG6-PHOSPHOGLUCONIC ACIDA,B2W8Z0.96
6PG6-PHOSPHOGLUCONIC ACIDA,B3E7F0.96
6PG6-PHOSPHOGLUCONIC ACIDA,B2W900.96
6PG6-PHOSPHOGLUCONIC ACIDA,B1KO80.96
6PG6-PHOSPHOGLUCONIC ACIDA,B2CXR0.96
6PG6-PHOSPHOGLUCONIC ACIDA2IYO0.96
6PG6-PHOSPHOGLUCONIC ACIDA,B1DQR0.96
GCW4-O-METHYL-BETA-D-GLUCURONIC ACIDA1L8N0.71
DRZ3',4'-DIHYDROXY-PENTANAL-5'-PHOSPHATEA,C1M3Q0.71
P6T1,6-di-O-phosphono-D-tagatoseA,B3GAY0.88
RUBRIBULOSE-1,5-DIPHOSPHATEA,B9RUB0.79
RUBRIBULOSE-1,5-DIPHOSPHATEB,E,H,K,L,O,
R,V		1RCX0.79
RUBRIBULOSE-1,5-DIPHOSPHATEB,E,H,L1RXO0.79
PA55-PHOSPHOARABINONIC ACIDA1NUH0.88
PA55-PHOSPHOARABINONIC ACIDA1X820.88
PA55-PHOSPHOARABINONIC ACIDA,B1QXR0.88
PA55-PHOSPHOARABINONIC ACIDA,B1G980.88
PA55-PHOSPHOARABINONIC ACIDA,B1TZC0.88
PA55-PHOSPHOARABINONIC ACIDA1GZV0.88
PA55-PHOSPHOARABINONIC ACIDA1X7N0.88
PA55-PHOSPHOARABINONIC ACIDA1C7R0.88
GTRGALACTURONIC ACIDA1KCD0.72
GTRGALACTURONIC ACIDA1KCC0.72
GTRGALACTURONIC ACIDA1N7Q0.72
RSH3-DEOXY-D-LYXO-HEXONIC ACIDA,B,C,D1W3T0.81
CAP2-CARBOXYARABINITOL-1,5-DIPHOSPHATEL1RLC0.81
CAP2-CARBOXYARABINITOL-1,5-DIPHOSPHATE1,2,3,4,5,6,
7,8,A,B,C,D,
E,F,G,H,I,J,
K,L,M,N,O,P,
S,T,U,V,W,X,
Y,Z		1IR20.81
CAP2-CARBOXYARABINITOL-1,5-DIPHOSPHATEA,B,C,D,E,F,
G,H		1RBL0.81
CAP2-CARBOXYARABINITOL-1,5-DIPHOSPHATEA,B,C,E,H,I,
J,K,M,O,P,R,
T,V,W		1UW90.81
CAP2-CARBOXYARABINITOL-1,5-DIPHOSPHATEA,B,C,D4RUB0.81
CAP2-CARBOXYARABINITOL-1,5-DIPHOSPHATEA,C,E,G8RUC0.81
CAP2-CARBOXYARABINITOL-1,5-DIPHOSPHATEA,B,D,E,H,K,
O,R,V		1UWA0.81
CAP2-CARBOXYARABINITOL-1,5-DIPHOSPHATEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P		2VDH0.81
CAP2-CARBOXYARABINITOL-1,5-DIPHOSPHATEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P		2V630.81
CAP2-CARBOXYARABINITOL-1,5-DIPHOSPHATEA,B,C,E,F,H,
I,J,K,M,O,P,
R,T,V,W		1UZD0.81
CAP2-CARBOXYARABINITOL-1,5-DIPHOSPHATEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P		2VDI0.81
CAP2-CARBOXYARABINITOL-1,5-DIPHOSPHATEA,C,E,G,I,K,
M,O		1GK80.81
CAP2-CARBOXYARABINITOL-1,5-DIPHOSPHATEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P		2V6A0.81
CAP2-CARBOXYARABINITOL-1,5-DIPHOSPHATEA,C,E,G1UPP0.81
CAP2-CARBOXYARABINITOL-1,5-DIPHOSPHATEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P		2V690.81
CAP2-CARBOXYARABINITOL-1,5-DIPHOSPHATEA,B,C,E,F,H,
J,K,M,O,P,R,
T,V,W		1UZH0.81
CAP2-CARBOXYARABINITOL-1,5-DIPHOSPHATEA,C,E,G1BWV0.81
CAP2-CARBOXYARABINITOL-1,5-DIPHOSPHATEA,E,S,W1WDD0.81
CAP2-CARBOXYARABINITOL-1,5-DIPHOSPHATEB,E,H,K,L,O,
R,V		1UPM0.81
CAP2-CARBOXYARABINITOL-1,5-DIPHOSPHATEA,B,C,D,S,T,
U,V		1IR10.81
CAP2-CARBOXYARABINITOL-1,5-DIPHOSPHATEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P		2V670.81
CAP2-CARBOXYARABINITOL-1,5-DIPHOSPHATEB,E,H,L1RBO0.81
CAP2-CARBOXYARABINITOL-1,5-DIPHOSPHATEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P		2V680.81
DXG4-DEOXYGLUCARATEA,B,C,D1ECQ0.84
MAVD-MANNURONIC ACIDA,B1J1N0.72
MAVD-MANNURONIC ACIDA1Y3P0.72
MAVD-MANNURONIC ACIDA,B,D2PYH0.72
MAVD-MANNURONIC ACIDA1Y3N0.72
MAVD-MANNURONIC ACIDA1HV60.72
G6QGLUCOSE-6-PHOSPHATEA,B3FF10.88
G6QGLUCOSE-6-PHOSPHATEA,B,C2O2C0.88
G6QGLUCOSE-6-PHOSPHATEA,B2J6H0.88
G6QGLUCOSE-6-PHOSPHATEA,B1JXA0.88
G6QGLUCOSE-6-PHOSPHATEA,B1U0F0.88
G6QGLUCOSE-6-PHOSPHATEA,B1X9I0.88
IDRL-IDURONIC ACIDA2V380.72
IDRL-IDURONIC ACIDA1HM20.72
IDRL-IDURONIC ACIDA2ERM0.72
R525-O-phosphono-D-riboseA,B,C,D,E2VVP0.78
I1N(2S,3R,4R,5S,6S)-2,3,4,5,6-PENTAHYDROXYCYCLOHEXANONEA,B2IBN0.78
XBPXYLULOSE-1,5-BISPHOSPHATEA,B,C,D,E,F,
G,H		1RSC0.79
2FP1,6-FRUCTOSE DIPHOSPHATE (LINEAR FORM)A,B,C,D1FDJ0.88
2FP1,6-FRUCTOSE DIPHOSPHATE (LINEAR FORM)A,B6ALD0.88
2FP1,6-FRUCTOSE DIPHOSPHATE (LINEAR FORM)A,B,C,D1ZAI0.88
2FP1,6-FRUCTOSE DIPHOSPHATE (LINEAR FORM)A,B,C,D2QDG0.88
2FP1,6-FRUCTOSE DIPHOSPHATE (LINEAR FORM)A3ELF0.88
2FP1,6-FRUCTOSE DIPHOSPHATE (LINEAR FORM)A4ALD0.88
2FP1,6-FRUCTOSE DIPHOSPHATE (LINEAR FORM)A1UMG0.88
ADAALPHA-D-GALACTOPYRANURONIC ACIDC,D2NST0.72
ADAALPHA-D-GALACTOPYRANURONIC ACIDA1GXO0.72
ADAALPHA-D-GALACTOPYRANURONIC ACIDA2EWE0.72
ADAALPHA-D-GALACTOPYRANURONIC ACIDA2UVH0.72
ADAALPHA-D-GALACTOPYRANURONIC ACIDA2O040.72
ADAALPHA-D-GALACTOPYRANURONIC ACIDC,D2NTB0.72
ADAALPHA-D-GALACTOPYRANURONIC ACIDC,D2NT90.72
ADAALPHA-D-GALACTOPYRANURONIC ACIDA2NZM0.72
ADAALPHA-D-GALACTOPYRANURONIC ACIDA,B2Z8S0.72
ADAALPHA-D-GALACTOPYRANURONIC ACIDA2UVJ0.72
ADAALPHA-D-GALACTOPYRANURONIC ACIDA2O0V0.72
ADAALPHA-D-GALACTOPYRANURONIC ACIDC,D2NSP0.72
ADAALPHA-D-GALACTOPYRANURONIC ACIDA,B3B8Y0.72
ADAALPHA-D-GALACTOPYRANURONIC ACIDC,D2NT60.72
ADAALPHA-D-GALACTOPYRANURONIC ACIDA2O170.72
ADAALPHA-D-GALACTOPYRANURONIC ACIDC,D2NTP0.72
ADAALPHA-D-GALACTOPYRANURONIC ACIDA2O1D0.72
ADAALPHA-D-GALACTOPYRANURONIC ACIDC,D2NTQ0.72
DEZ4-PHOSPHO-D-ERYTHRONATEA,B,C,D,E2BET0.79
1N5(2R,4S)-2,4,7-trihydroxyheptanoic acidA,B3CXO0.7
LGUALPHA-L-GULURONATEA2ZAC0.72
LGUALPHA-L-GULURONATEA2ZAA0.72
LGUALPHA-L-GULURONATEA,B2QJR0.72
LGUALPHA-L-GULURONATEA2ZAB0.72
LGUALPHA-L-GULURONATEA,B1J1N0.72
LGUALPHA-L-GULURONATEA1Y3P0.72
LG6L-GULURONIC ACID 6-PHOSPHATEA,B1KW10.96
LG6L-GULURONIC ACID 6-PHOSPHATEA,B1Q6O0.96
LI52-HYDROXY-4,5-DIOXOHEPTYL HYDROGEN PHOSPHONATEA,B1YCD0.73
3LR3,6-dideoxy-L-arabino-hexonic acidA,B3CXO0.79
LFC6-DEOXY-L-GALACTONIC ACIDA2HXU0.83
LGTL-GLUCARIC ACIDA,B,C,D3CB30.86
LGTL-GLUCARIC ACIDA,B,C2PP30.86
GCT4,5-DIHYDROXY-TETRAHYDRO-PYRAN-
2-CARBOXYLIC ACID		A1RWG0.73
GCT4,5-DIHYDROXY-TETRAHYDRO-PYRAN-
2-CARBOXYLIC ACID		A1RWF0.73
GCT4,5-DIHYDROXY-TETRAHYDRO-PYRAN-
2-CARBOXYLIC ACID		A1RWH0.73
KDG2-KETO-3-DEOXYGLUCONATEA,B1V1A0.86
KDG2-KETO-3-DEOXYGLUCONATEA,B,C2VAR0.86
KDG2-KETO-3-DEOXYGLUCONATEA,B,C,D2QJN0.86
CRB[1R-(1ALPHA,3BETA,4ALPHA,5BETA)]-
5-(PHOSPHONOMETHYL)-1,3,4-TRIHYDROXYCYCLOHEXANE-
1-CARBOXYLIC ACID		A,B1XAI0.71
CRB[1R-(1ALPHA,3BETA,4ALPHA,5BETA)]-
5-(PHOSPHONOMETHYL)-1,3,4-TRIHYDROXYCYCLOHEXANE-
1-CARBOXYLIC ACID		A,B1NVD0.71
CRB[1R-(1ALPHA,3BETA,4ALPHA,5BETA)]-
5-(PHOSPHONOMETHYL)-1,3,4-TRIHYDROXYCYCLOHEXANE-
1-CARBOXYLIC ACID		A1XAG0.71
CRB[1R-(1ALPHA,3BETA,4ALPHA,5BETA)]-
5-(PHOSPHONOMETHYL)-1,3,4-TRIHYDROXYCYCLOHEXANE-
1-CARBOXYLIC ACID		A,B1NR50.71
CRB[1R-(1ALPHA,3BETA,4ALPHA,5BETA)]-
5-(PHOSPHONOMETHYL)-1,3,4-TRIHYDROXYCYCLOHEXANE-
1-CARBOXYLIC ACID		A,B1XAJ0.71
CRB[1R-(1ALPHA,3BETA,4ALPHA,5BETA)]-
5-(PHOSPHONOMETHYL)-1,3,4-TRIHYDROXYCYCLOHEXANE-
1-CARBOXYLIC ACID		A,B1XAL0.71
CRB[1R-(1ALPHA,3BETA,4ALPHA,5BETA)]-
5-(PHOSPHONOMETHYL)-1,3,4-TRIHYDROXYCYCLOHEXANE-
1-CARBOXYLIC ACID		A,B1DQS0.71
CRB[1R-(1ALPHA,3BETA,4ALPHA,5BETA)]-
5-(PHOSPHONOMETHYL)-1,3,4-TRIHYDROXYCYCLOHEXANE-
1-CARBOXYLIC ACID		A,B1NVB0.71
CRB[1R-(1ALPHA,3BETA,4ALPHA,5BETA)]-
5-(PHOSPHONOMETHYL)-1,3,4-TRIHYDROXYCYCLOHEXANE-
1-CARBOXYLIC ACID		A,B,C1NVF0.71
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
F6RFRUCTOSE -6-PHOSPHATEA,B1X9H0.89
F6RFRUCTOSE -6-PHOSPHATEA,B,C,D2PUT0.89
F6RFRUCTOSE -6-PHOSPHATEA,B2BKX0.89
F6RFRUCTOSE -6-PHOSPHATEA,B,C2BPL0.89
F6RFRUCTOSE -6-PHOSPHATEA,B1FQO0.89
F6RFRUCTOSE -6-PHOSPHATEA,B,C,D2V4M0.89