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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03078902

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
P6T1,6-di-O-phosphono-D-tagatoseA,B3GAY0.98
HMS5-O-phosphono-L-ribuloseA,B1XBX0.9
R105-O-phosphono-D-ribonic acidA,B,C,D,E2VVQ0.87
IP2D-MYO-INOSITOL-4,5-BISPHOSPHATEA1HG20.72
IP2D-MYO-INOSITOL-4,5-BISPHOSPHATEA,B1DJZ0.72
G6QGLUCOSE-6-PHOSPHATEA,B3FF10.91
G6QGLUCOSE-6-PHOSPHATEA,B,C2O2C0.91
G6QGLUCOSE-6-PHOSPHATEA,B2J6H0.91
G6QGLUCOSE-6-PHOSPHATEA,B1JXA0.91
G6QGLUCOSE-6-PHOSPHATEA,B1U0F0.91
G6QGLUCOSE-6-PHOSPHATEA,B1X9I0.91
2IPD-MYO-INOSITOL-1,4-BISPHOSPHATEA1I9Z0.72
A5PARABINOSE-5-PHOSPHATEA1UJ60.71
A5PARABINOSE-5-PHOSPHATEA,B1FXQ0.71
A5PARABINOSE-5-PHOSPHATEA,B,C,D,E,F,
G,H,I,J,K,L		2NX30.71
A5PARABINOSE-5-PHOSPHATEA,B1LRQ0.71
A5PARABINOSE-5-PHOSPHATEA,B2CXP0.71
A5PARABINOSE-5-PHOSPHATEA,B1T8X0.71
A5PARABINOSE-5-PHOSPHATEA,B2EF90.71
A5PARABINOSE-5-PHOSPHATEA,B1FY60.71
A5PARABINOSE-5-PHOSPHATEA,B2NWS0.71
A5PARABINOSE-5-PHOSPHATEA,B2NXG0.71
A5PARABINOSE-5-PHOSPHATEA,B2A2I0.71
A5PARABINOSE-5-PHOSPHATEA,B1FWW0.71
LI52-HYDROXY-4,5-DIOXOHEPTYL HYDROGEN PHOSPHONATEA,B1YCD0.81
GCOGLUCONIC ACIDB,C,D1BGG0.77
GCOGLUCONIC ACIDA,B1XLF0.77
IBSL-ALPHA-GLYCEROPHOSPHO-D-MYO-INOSITOL-
4,5-BIS-PHOSPHATE		A1I7E0.77
F2P1,6-DI-O-PHOSPHONO-D-ALLITOLA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P,Q,R,
S,T		2QJG0.74
F2P1,6-DI-O-PHOSPHONO-D-ALLITOLA,B,C,D,E,F,
G,H,I,J		1W8R0.74
LGC(3S,4R,5R,6S)-3,4,5-TRIHYDROXY-
6-(HYDROXYMETHYL)TETRAHYDRO-2H-
PYRAN-2-ONE		M1E6X0.7
LGC(3S,4R,5R,6S)-3,4,5-TRIHYDROXY-
6-(HYDROXYMETHYL)TETRAHYDRO-2H-
PYRAN-2-ONE		A,B2E400.7
LGC(3S,4R,5R,6S)-3,4,5-TRIHYDROXY-
6-(HYDROXYMETHYL)TETRAHYDRO-2H-
PYRAN-2-ONE		A2VWG0.7
LGC(3S,4R,5R,6S)-3,4,5-TRIHYDROXY-
6-(HYDROXYMETHYL)TETRAHYDRO-2H-
PYRAN-2-ONE		A,B3EQO0.7
149D-GALCTOPYRANOSYL-1-ONA,B,C,D1JZ50.7
149D-GALCTOPYRANOSYL-1-ONA,B,C,D3CZJ0.7
R525-O-phosphono-D-riboseA,B,C,D,E2VVP0.87
2FP1,6-FRUCTOSE DIPHOSPHATE (LINEAR FORM)A,B,C,D1FDJ0.98
2FP1,6-FRUCTOSE DIPHOSPHATE (LINEAR FORM)A,B6ALD0.98
2FP1,6-FRUCTOSE DIPHOSPHATE (LINEAR FORM)A,B,C,D1ZAI0.98
2FP1,6-FRUCTOSE DIPHOSPHATE (LINEAR FORM)A,B,C,D2QDG0.98
2FP1,6-FRUCTOSE DIPHOSPHATE (LINEAR FORM)A3ELF0.98
2FP1,6-FRUCTOSE DIPHOSPHATE (LINEAR FORM)A4ALD0.98
2FP1,6-FRUCTOSE DIPHOSPHATE (LINEAR FORM)A1UMG0.98
5RPRIBULOSE-5-PHOSPHATEA,B1XBY0.9
5RPRIBULOSE-5-PHOSPHATEA,B1XBX0.9
5RPRIBULOSE-5-PHOSPHATEA1UJ50.9
5RPRIBULOSE-5-PHOSPHATEA,B1PVY0.9
5RPRIBULOSE-5-PHOSPHATEA2RIU0.9
5RPRIBULOSE-5-PHOSPHATEA,B1SNN0.9
5RPRIBULOSE-5-PHOSPHATEA,B1TKU0.9
5RPRIBULOSE-5-PHOSPHATEA,B3HHE0.9
5RPRIBULOSE-5-PHOSPHATEA,B1XBV0.9
5RPRIBULOSE-5-PHOSPHATEA,B,C2ISS0.9
5RPRIBULOSE-5-PHOSPHATEA,B,C2IYP0.9
5RPRIBULOSE-5-PHOSPHATEA,B,C,D,E2VVP0.9
KDP2-KETO-DEOXY-GALACTOSEA2V820.91
I2PD-MYO-INOSITOL-2,4,5-TRIPHOSPHATEA,B1DJY0.72
S6PD-SORBITOL-6-PHOSPHATEA,B2CXQ0.76
S6PD-SORBITOL-6-PHOSPHATEA,B1XTB0.76
S6PD-SORBITOL-6-PHOSPHATEA,B2GC10.76
S6PD-SORBITOL-6-PHOSPHATEA,B,C,D,E,F3CTL0.76
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		2DCN0.78
DG62-DEOXY-GLUCITOL-6-PHOSPHATEA,B1JKI0.76
KDG2-KETO-3-DEOXYGLUCONATEA,B1V1A0.79
KDG2-KETO-3-DEOXYGLUCONATEA,B,C2VAR0.79
KDG2-KETO-3-DEOXYGLUCONATEA,B,C,D2QJN0.79
ITPPHOSPHORIC ACID MONO-(2,3,4,6-TETRAHYDROXY-
5-PHOSPHONOOXY-CYCLOHEXYL) ESTER		A,B1JOC0.72
ITPPHOSPHORIC ACID MONO-(2,3,4,6-TETRAHYDROXY-
5-PHOSPHONOOXY-CYCLOHEXYL) ESTER		A1HYI0.72
3LR3,6-dideoxy-L-arabino-hexonic acidA,B3CXO0.72
R5PRIBOSE-5-PHOSPHATEA,B,C,D1U9Z0.71
R5PRIBOSE-5-PHOSPHATEA1V8T0.71
R5PRIBOSE-5-PHOSPHATEA,B1ZHA0.71
R5PRIBOSE-5-PHOSPHATEA,B1ZJI0.71
R5PRIBOSE-5-PHOSPHATEA,B1JCY0.71
R5PRIBOSE-5-PHOSPHATEA,B2R5N0.71
LGTL-GLUCARIC ACIDA,B,C,D3CB30.79
LGTL-GLUCARIC ACIDA,B,C2PP30.79
LFC6-DEOXY-L-GALACTONIC ACIDA2HXU0.75
1NT(2R,4R,5R,6R,7R)-2,4,5,6,7-PENTAHYDROXY-
2,8-BIS(PHOSPHONOOXY)OCTANOIC ACID		A,B2NXG0.76
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		2NX30.76
MRU5-S-METHYL-1-O-PHOSPHONO-5-THIO-
D-RIBULOSE		A,B,C,D2YVK0.72
RSH3-DEOXY-D-LYXO-HEXONIC ACIDA,B,C,D1W3T0.73
E4PERYTHOSE-4-PHOSPHATEA,B1NGS0.75
E4PERYTHOSE-4-PHOSPHATEA,B1U0G0.75
E4PERYTHOSE-4-PHOSPHATEA,B1FWT0.75
E4PERYTHOSE-4-PHOSPHATEA,B1RZM0.75
E4PERYTHOSE-4-PHOSPHATEA,B,C,D1IRI0.75
XLSD-XYLOSE (LINEAR FORM)A,B2QW50.74
XLSD-XYLOSE (LINEAR FORM)A2BRP0.74
XLSD-XYLOSE (LINEAR FORM)A3XIS0.74
XLSD-XYLOSE (LINEAR FORM)A,B,C,D8XIM0.74
XLSD-XYLOSE (LINEAR FORM)A4XIS0.74
XLSD-XYLOSE (LINEAR FORM)A,B,C,D9XIM0.74
XLSD-XYLOSE (LINEAR FORM)A,B,C,D5XIN0.74
XLSD-XYLOSE (LINEAR FORM)A8XIA0.74
XLSD-XYLOSE (LINEAR FORM)A,B,C,D6XIM0.74
XLSD-XYLOSE (LINEAR FORM)A1XIC0.74
I1N(2S,3R,4R,5S,6S)-2,3,4,5,6-PENTAHYDROXYCYCLOHEXANONEA,B2IBN0.8
I3PD-MYO-INOSITOL-1,4,5-TRIPHOSPHATEA1H0A0.72
I3PD-MYO-INOSITOL-1,4,5-TRIPHOSPHATEA1NU20.72
I3PD-MYO-INOSITOL-1,4,5-TRIPHOSPHATEA1GC60.72
I3PD-MYO-INOSITOL-1,4,5-TRIPHOSPHATEA1MAI0.72
I3PD-MYO-INOSITOL-1,4,5-TRIPHOSPHATEA2P0D0.72
I3PD-MYO-INOSITOL-1,4,5-TRIPHOSPHATEA,B1OQN0.72
I3PD-MYO-INOSITOL-1,4,5-TRIPHOSPHATEA1U290.72
I3PD-MYO-INOSITOL-1,4,5-TRIPHOSPHATEA,B1W2C0.72
I3PD-MYO-INOSITOL-1,4,5-TRIPHOSPHATEA,B1DJX0.72
I3PD-MYO-INOSITOL-1,4,5-TRIPHOSPHATEA2A980.72
I3PD-MYO-INOSITOL-1,4,5-TRIPHOSPHATEA1N4K0.72
I3PD-MYO-INOSITOL-1,4,5-TRIPHOSPHATEA,B3C5N0.72
I3PD-MYO-INOSITOL-1,4,5-TRIPHOSPHATEA1BTN0.72
DEZ4-PHOSPHO-D-ERYTHRONATEA,B,C,D,E2BET0.78
FUDD-fructoseA,B,C,D2QUN0.86
DX5D-XYLITOL-5-PHOSPHATEA,B,C,D,E,F,
G,H,I,J,K,L		2FLI0.71
GLOD-GLUCOSE IN LINEAR FORMA,B1XYB0.78
GLOD-GLUCOSE IN LINEAR FORMA1FQD0.78
GLOD-GLUCOSE IN LINEAR FORMA,B1XYM0.78
GLOD-GLUCOSE IN LINEAR FORMA,B1EZ90.78
GLOD-GLUCOSE IN LINEAR FORMA1FBO0.78
GLOD-GLUCOSE IN LINEAR FORMA1AC00.78
GLOD-GLUCOSE IN LINEAR FORMA1FQC0.78
I3S(1S,3S,4S)-1,3,4-TRIPHOSPHO-MYO-
INOSITOL		X1Z2P0.72
I3S(1S,3S,4S)-1,3,4-TRIPHOSPHO-MYO-
INOSITOL		A2P0H0.72
CS2D-MANNONIC ACIDA,B,C,D2QJM0.77
CS2D-MANNONIC ACIDA,B3DBN0.77
TAGD-tagatoseA,B,C,D2QUM0.86
F6RFRUCTOSE -6-PHOSPHATEA,B1X9H1
F6RFRUCTOSE -6-PHOSPHATEA,B,C,D2PUT1
F6RFRUCTOSE -6-PHOSPHATEA,B2BKX1
F6RFRUCTOSE -6-PHOSPHATEA,B,C2BPL1
F6RFRUCTOSE -6-PHOSPHATEA,B1FQO1
F6RFRUCTOSE -6-PHOSPHATEA,B,C,D2V4M1
XBPXYLULOSE-1,5-BISPHOSPHATEA,B,C,D,E,F,
G,H		1RSC0.88
AOSD-ALLOSEA,B,C,D2I570.78
LIPL-MYO-INOSITOL-1-PHOSPHATEA,B1IMB0.74
LIPL-MYO-INOSITOL-1-PHOSPHATEA,B3C4V0.74
LXPL-XYLITOL 5-PHOSPHATEA,B1Q6Q0.71
PA55-PHOSPHOARABINONIC ACIDA1NUH0.87
PA55-PHOSPHOARABINONIC ACIDA1X820.87
PA55-PHOSPHOARABINONIC ACIDA,B1QXR0.87
PA55-PHOSPHOARABINONIC ACIDA,B1G980.87
PA55-PHOSPHOARABINONIC ACIDA,B1TZC0.87
PA55-PHOSPHOARABINONIC ACIDA1GZV0.87
PA55-PHOSPHOARABINONIC ACIDA1X7N0.87
PA55-PHOSPHOARABINONIC ACIDA1C7R0.87
GKRD-GLUCARATEA3CXT0.79
GKRD-GLUCARATEA,B1JCT0.79
3MF3-O-METHYLFRUCTOSE IN LINEAR FORMA,B1XYC0.8
DXP1-DEOXY-D-XYLULOSE-5-PHOSPHATEB,C,D,E,F,G,H3GK00.83
DXP1-DEOXY-D-XYLULOSE-5-PHOSPHATEA,B,C,E,F,G1M5W0.83
DXP1-DEOXY-D-XYLULOSE-5-PHOSPHATEA,B,C,D1IXN0.83
DXP1-DEOXY-D-XYLULOSE-5-PHOSPHATEA,B1Q0Q0.83
KD03-deoxy-8-O-phosphono-D-manno-oct-
2-ulosonic acid		A,B3E120.84
DNOD-mannoseA3BDK0.78
DRZ3',4'-DIHYDROXY-PENTANAL-5'-PHOSPHATEA,C1M3Q0.79
KBG2-KETO-BETA-D-GLUCOSEA2F5V0.71
KBG2-KETO-BETA-D-GLUCOSEA1FQ70.71
6PG6-PHOSPHOGLUCONIC ACIDA1PGP0.89
6PG6-PHOSPHOGLUCONIC ACIDA,B1J3R0.89
6PG6-PHOSPHOGLUCONIC ACIDA,B1QY40.89
6PG6-PHOSPHOGLUCONIC ACIDA,B2W8Z0.89
6PG6-PHOSPHOGLUCONIC ACIDA,B3E7F0.89
6PG6-PHOSPHOGLUCONIC ACIDA,B2W900.89
6PG6-PHOSPHOGLUCONIC ACIDA,B1KO80.89
6PG6-PHOSPHOGLUCONIC ACIDA,B2CXR0.89
6PG6-PHOSPHOGLUCONIC ACIDA2IYO0.89
6PG6-PHOSPHOGLUCONIC ACIDA,B1DQR0.89
RUBRIBULOSE-1,5-DIPHOSPHATEA,B9RUB0.88
RUBRIBULOSE-1,5-DIPHOSPHATEB,E,H,K,L,O,
R,V		1RCX0.88
RUBRIBULOSE-1,5-DIPHOSPHATEB,E,H,L1RXO0.88
RNSL-RHAMNOSEA,B,C,D1X8D0.71
RNSL-RHAMNOSEA,B,C,D1DE60.71
RNSL-RHAMNOSEA,B,C,D2I560.71
S703-HYDROXY-2-OXO-4-PHOPHONOXY- BUTYL)-
PHOSPHONIC ACID		A,B,C,D1QXS0.72
DERD-4-PHOSPHOERYTHRONIC ACIDA,B,C,D1LK70.78
DERD-4-PHOSPHOERYTHRONIC ACIDA,B2CXO0.78
M2PD-MANNITOL-1,6-DIPHOSPHATEA2Q8J0.74
M2PD-MANNITOL-1,6-DIPHOSPHATEA,B,C,D2QDH0.74
M2PD-MANNITOL-1,6-DIPHOSPHATEA,B,C,D1ZAJ0.74
FPCD-FRUCTOSE-6-PHOSPHATE (OPEN FORM)A,B1FQO0.76
FPCD-FRUCTOSE-6-PHOSPHATE (OPEN FORM)A,B2GC20.76
IPDD-MYO-INOSITOL-1-PHOSPHATEA,B1IMA0.74
IPDD-MYO-INOSITOL-1-PHOSPHATEA,B1G0H0.74
IPDD-MYO-INOSITOL-1-PHOSPHATEA,B,C2ORK0.74
IPDD-MYO-INOSITOL-1-PHOSPHATEA,B1AWB0.74
IPDD-MYO-INOSITOL-1-PHOSPHATEA,B1LBX0.74
DXG4-DEOXYGLUCARATEA,B,C,D1ECQ0.77
SSH3-DEOXY-D-ARABINO-HEXONIC ACIDA,B,C,D1W3N0.73
LG6L-GULURONIC ACID 6-PHOSPHATEA,B1KW10.89
LG6L-GULURONIC ACID 6-PHOSPHATEA,B1Q6O0.89
P6F1,6-di-O-phosphono-D-fructoseA,B3GB60.98
GLR2,3-DIHYDROXY-5-OXO-HEXANEDIOATEA,B,C,D1EC80.74
GLR2,3-DIHYDROXY-5-OXO-HEXANEDIOATEA,B,C,D1JDF0.74
CAP2-CARBOXYARABINITOL-1,5-DIPHOSPHATEL1RLC0.8
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		1IR20.8
CAP2-CARBOXYARABINITOL-1,5-DIPHOSPHATEA,B,C,D,E,F,
G,H		1RBL0.8
CAP2-CARBOXYARABINITOL-1,5-DIPHOSPHATEA,B,C,E,H,I,
J,K,M,O,P,R,
T,V,W		1UW90.8
CAP2-CARBOXYARABINITOL-1,5-DIPHOSPHATEA,B,C,D4RUB0.8
CAP2-CARBOXYARABINITOL-1,5-DIPHOSPHATEA,C,E,G8RUC0.8
CAP2-CARBOXYARABINITOL-1,5-DIPHOSPHATEA,B,D,E,H,K,
O,R,V		1UWA0.8
CAP2-CARBOXYARABINITOL-1,5-DIPHOSPHATEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P		2VDH0.8
CAP2-CARBOXYARABINITOL-1,5-DIPHOSPHATEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P		2V630.8
CAP2-CARBOXYARABINITOL-1,5-DIPHOSPHATEA,B,C,E,F,H,
I,J,K,M,O,P,
R,T,V,W		1UZD0.8
CAP2-CARBOXYARABINITOL-1,5-DIPHOSPHATEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P		2VDI0.8
CAP2-CARBOXYARABINITOL-1,5-DIPHOSPHATEA,C,E,G,I,K,
M,O		1GK80.8
CAP2-CARBOXYARABINITOL-1,5-DIPHOSPHATEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P		2V6A0.8
CAP2-CARBOXYARABINITOL-1,5-DIPHOSPHATEA,C,E,G1UPP0.8
CAP2-CARBOXYARABINITOL-1,5-DIPHOSPHATEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P		2V690.8
CAP2-CARBOXYARABINITOL-1,5-DIPHOSPHATEA,B,C,E,F,H,
J,K,M,O,P,R,
T,V,W		1UZH0.8
CAP2-CARBOXYARABINITOL-1,5-DIPHOSPHATEA,C,E,G1BWV0.8
CAP2-CARBOXYARABINITOL-1,5-DIPHOSPHATEA,E,S,W1WDD0.8
CAP2-CARBOXYARABINITOL-1,5-DIPHOSPHATEB,E,H,K,L,O,
R,V		1UPM0.8
CAP2-CARBOXYARABINITOL-1,5-DIPHOSPHATEA,B,C,D,S,T,
U,V		1IR10.8
CAP2-CARBOXYARABINITOL-1,5-DIPHOSPHATEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P		2V670.8
CAP2-CARBOXYARABINITOL-1,5-DIPHOSPHATEB,E,H,L1RBO0.8
CAP2-CARBOXYARABINITOL-1,5-DIPHOSPHATEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P		2V680.8
I22D-ALTRO-HEPT-2-ULOSE 7-PHOSPHATEB2I220.93
XULD-XYLULOSEA3CWH0.76
XULD-XYLULOSEA1XII0.76
XULD-XYLULOSEA,B2ITM0.76