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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03079123

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
3HD3-O-METHYL-O-ALPHA-D-MANNOPYRANOSYLA2HGO0.7
2IPD-MYO-INOSITOL-1,4-BISPHOSPHATEA1I9Z1
2FP1,6-FRUCTOSE DIPHOSPHATE (LINEAR FORM)A,B,C,D1FDJ0.74
2FP1,6-FRUCTOSE DIPHOSPHATE (LINEAR FORM)A,B6ALD0.74
2FP1,6-FRUCTOSE DIPHOSPHATE (LINEAR FORM)A,B,C,D1ZAI0.74
2FP1,6-FRUCTOSE DIPHOSPHATE (LINEAR FORM)A,B,C,D2QDG0.74
2FP1,6-FRUCTOSE DIPHOSPHATE (LINEAR FORM)A3ELF0.74
2FP1,6-FRUCTOSE DIPHOSPHATE (LINEAR FORM)A4ALD0.74
2FP1,6-FRUCTOSE DIPHOSPHATE (LINEAR FORM)A1UMG0.74
5IP(1R,2R,3R,4R,5S,6S)-6-HYDROXYCYCLOHEXANE-
1,2,3,4,5-PENTAYL PENTAKIS[DIHYDROGEN (PHOSPHATE)]
A2I5F0.93
AFPALPHA FRUCTOSE 1,6-DIPHOSPHATEA,B1FBH0.8
AFPALPHA FRUCTOSE 1,6-DIPHOSPHATEA1LLC0.8
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,B,F1OE50.72
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,B,C,D,E,F,
G,H,I,J,K,L
1Q9X0.72
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,B,C2NP70.72
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,D1PM50.72
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,B2OFI0.72
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,B,F1OE40.72
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEU,X1DE80.72
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,B1FZS0.72
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,C2NQ90.72
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,B,C,D,E,F2NP60.72
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATED1PHJ0.72
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,B,C2NQJ0.72
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,P,T2OZM0.72
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEC1N390.72
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEC1N3A0.72
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,B,V,Y1DE90.72
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,C2IH50.72
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,B,C,D,E,I2P5O0.72
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,B1FZL0.72
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,B,C,D,I2P5G0.72
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,B,C,D1M5R0.72
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,B,C1Y6F0.72
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,B1P5W0.72
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,D9MHT0.72
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,P,T3G6X0.72
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,P,T3G6V0.72
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,D1PJJ0.72
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,B1YCT0.72
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,P,T3G6Y0.72
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATED2RBA0.72
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATED1FN70.72
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEX1M060.72
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,B,C1P590.72
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEB,U,X1DEW0.72
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,B1HT40.72
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,C1QUM0.72
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,B1YCW0.72
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,B,C,D1IXY0.72
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,B,C1N480.72
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,C,E,F,I,J,K2OYQ0.72
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,F1OE60.72
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEE,G,I,K2DTU0.72
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,D,G,H1PH50.72
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,B1HT70.72
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,G3EI20.72
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,B,D,F1N560.72
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,B,C,D,E,F2IBT0.72
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,C,D2P660.72
CIPINOSITOL-2-METHYLENE-1,2-CYCLIC-
MONOPHOSPHATE
A,B1DJW0.71
A6P6-O-phosphono-alpha-D-allopyranoseA,B,C,D,E2VVO0.78
4IPINOSITOL-(1,3,4,5)-TETRAKISPHOSPHATEA1U270.93
4IPINOSITOL-(1,3,4,5)-TETRAKISPHOSPHATEA1FAO0.93
4IPINOSITOL-(1,3,4,5)-TETRAKISPHOSPHATEA2UZS0.93
4IPINOSITOL-(1,3,4,5)-TETRAKISPHOSPHATEA1H100.93
4IPINOSITOL-(1,3,4,5)-TETRAKISPHOSPHATEA,B2R0D0.93
4IPINOSITOL-(1,3,4,5)-TETRAKISPHOSPHATEA,B1B550.93
4IPINOSITOL-(1,3,4,5)-TETRAKISPHOSPHATEA1W1D0.93
4IPINOSITOL-(1,3,4,5)-TETRAKISPHOSPHATEA,B1BWN0.93
4IPINOSITOL-(1,3,4,5)-TETRAKISPHOSPHATEA,B1W2D0.93
4IPINOSITOL-(1,3,4,5)-TETRAKISPHOSPHATEA,B1FHX0.93
4IPINOSITOL-(1,3,4,5)-TETRAKISPHOSPHATEA,B2R090.93
4IPINOSITOL-(1,3,4,5)-TETRAKISPHOSPHATEA1UNQ0.93
4IPINOSITOL-(1,3,4,5)-TETRAKISPHOSPHATEA1UPR0.93
4IPINOSITOL-(1,3,4,5)-TETRAKISPHOSPHATEA1FGY0.93
A5PARABINOSE-5-PHOSPHATEA1UJ60.86
A5PARABINOSE-5-PHOSPHATEA,B1FXQ0.86
A5PARABINOSE-5-PHOSPHATEA,B,C,D,E,F,
G,H,I,J,K,L
2NX30.86
A5PARABINOSE-5-PHOSPHATEA,B1LRQ0.86
A5PARABINOSE-5-PHOSPHATEA,B2CXP0.86
A5PARABINOSE-5-PHOSPHATEA,B1T8X0.86
A5PARABINOSE-5-PHOSPHATEA,B2EF90.86
A5PARABINOSE-5-PHOSPHATEA,B1FY60.86
A5PARABINOSE-5-PHOSPHATEA,B2NWS0.86
A5PARABINOSE-5-PHOSPHATEA,B2NXG0.86
A5PARABINOSE-5-PHOSPHATEA,B2A2I0.86
A5PARABINOSE-5-PHOSPHATEA,B1FWW0.86
CBU(1R,2R,3S,4S,5S,6S)-CYCLOHEXANE-
1,2,3,4,5,6-HEXOL
A,B2VT00.81
BG6BETA-D-GLUCOSE-6-PHOSPHATEA2CIR0.78
BG6BETA-D-GLUCOSE-6-PHOSPHATEA,B3BXG0.78
BG6BETA-D-GLUCOSE-6-PHOSPHATEA,B,C,D2POC0.78
BG6BETA-D-GLUCOSE-6-PHOSPHATEA,B2PUW0.78
BG6BETA-D-GLUCOSE-6-PHOSPHATEA1E7Y0.78
BG6BETA-D-GLUCOSE-6-PHOSPHATEA,B2NZT0.78
BG6BETA-D-GLUCOSE-6-PHOSPHATEA1E770.78
BG6BETA-D-GLUCOSE-6-PHOSPHATEA,B2BHL0.78
BG6BETA-D-GLUCOSE-6-PHOSPHATEA,B2Q8M0.78
BG6BETA-D-GLUCOSE-6-PHOSPHATEG,L2NZU0.78
CDI2C-METHYL-D-ERYTHRITOL 2,4-CYCLODIPHOSPHATEA1KNJ0.71
CDI2C-METHYL-D-ERYTHRITOL 2,4-CYCLODIPHOSPHATEA,B,C,D,E,F,
G,H
1H480.71
CDI2C-METHYL-D-ERYTHRITOL 2,4-CYCLODIPHOSPHATEA1JY80.71
ASO1,5-ANHYDROSORBITOLA1XIE0.72
ASO1,5-ANHYDROSORBITOLA3GUH0.72
ASO1,5-ANHYDROSORBITOLA,B2ASV0.72
ASO1,5-ANHYDROSORBITOLH,L2EC90.72
AHM2,5-ANHYDROMANNITOL-1,6-DIPHOSPHATEA,B1FBG0.85
AHM2,5-ANHYDROMANNITOL-1,6-DIPHOSPHATEA,B1FBF0.85
DG62-DEOXY-GLUCITOL-6-PHOSPHATEA,B1JKI0.93
CAK[(1R,2R,3S,4S,5R)-2,3,4,5-TETRAHYDROXYCYCLOHEXYL]METHYL DIHYDROGEN PHOSPHATEA,B2GRU0.82
AHG2,5-ANHYDROGLUCITOL-1,6-BIPHOSPHATEA,B1FBD0.85
AHG2,5-ANHYDROGLUCITOL-1,6-BIPHOSPHATEA,B1FBE0.85
AHG2,5-ANHYDROGLUCITOL-1,6-BIPHOSPHATEA,B1FPE0.85
AHG2,5-ANHYDROGLUCITOL-1,6-BIPHOSPHATEA,B1FPD0.85
AHG2,5-ANHYDROGLUCITOL-1,6-BIPHOSPHATEA,B1FBC0.85
AHG2,5-ANHYDROGLUCITOL-1,6-BIPHOSPHATEA,B1FPG0.85
AHG2,5-ANHYDROGLUCITOL-1,6-BIPHOSPHATEA,B1FPL0.85
AHG2,5-ANHYDROGLUCITOL-1,6-BIPHOSPHATEA,B1FPI0.85
AHG2,5-ANHYDROGLUCITOL-1,6-BIPHOSPHATEA,B1FPJ0.85
AHG2,5-ANHYDROGLUCITOL-1,6-BIPHOSPHATEA,B1FPF0.85
BGPBETA-GALACTOSE-6-PHOSPHATEA,B4PBG0.78
D6G2-DEOXY-GLUCOSE-6-PHOSPHATEA2PRI0.78