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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03079830

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
BG6BETA-D-GLUCOSE-6-PHOSPHATEA2CIR0.81
BG6BETA-D-GLUCOSE-6-PHOSPHATEA,B3BXG0.81
BG6BETA-D-GLUCOSE-6-PHOSPHATEA,B,C,D2POC0.81
BG6BETA-D-GLUCOSE-6-PHOSPHATEA,B2PUW0.81
BG6BETA-D-GLUCOSE-6-PHOSPHATEA1E7Y0.81
BG6BETA-D-GLUCOSE-6-PHOSPHATEA,B2NZT0.81
BG6BETA-D-GLUCOSE-6-PHOSPHATEA1E770.81
BG6BETA-D-GLUCOSE-6-PHOSPHATEA,B2BHL0.81
BG6BETA-D-GLUCOSE-6-PHOSPHATEA,B2Q8M0.81
BG6BETA-D-GLUCOSE-6-PHOSPHATEG,L2NZU0.81
4IPINOSITOL-(1,3,4,5)-TETRAKISPHOSPHATEA1U270.8
4IPINOSITOL-(1,3,4,5)-TETRAKISPHOSPHATEA1FAO0.8
4IPINOSITOL-(1,3,4,5)-TETRAKISPHOSPHATEA2UZS0.8
4IPINOSITOL-(1,3,4,5)-TETRAKISPHOSPHATEA1H100.8
4IPINOSITOL-(1,3,4,5)-TETRAKISPHOSPHATEA,B2R0D0.8
4IPINOSITOL-(1,3,4,5)-TETRAKISPHOSPHATEA,B1B550.8
4IPINOSITOL-(1,3,4,5)-TETRAKISPHOSPHATEA1W1D0.8
4IPINOSITOL-(1,3,4,5)-TETRAKISPHOSPHATEA,B1BWN0.8
4IPINOSITOL-(1,3,4,5)-TETRAKISPHOSPHATEA,B1W2D0.8
4IPINOSITOL-(1,3,4,5)-TETRAKISPHOSPHATEA,B1FHX0.8
4IPINOSITOL-(1,3,4,5)-TETRAKISPHOSPHATEA,B2R090.8
4IPINOSITOL-(1,3,4,5)-TETRAKISPHOSPHATEA1UNQ0.8
4IPINOSITOL-(1,3,4,5)-TETRAKISPHOSPHATEA1UPR0.8
4IPINOSITOL-(1,3,4,5)-TETRAKISPHOSPHATEA1FGY0.8
2FP1,6-FRUCTOSE DIPHOSPHATE (LINEAR FORM)A,B,C,D1FDJ0.7
2FP1,6-FRUCTOSE DIPHOSPHATE (LINEAR FORM)A,B6ALD0.7
2FP1,6-FRUCTOSE DIPHOSPHATE (LINEAR FORM)A,B,C,D1ZAI0.7
2FP1,6-FRUCTOSE DIPHOSPHATE (LINEAR FORM)A,B,C,D2QDG0.7
2FP1,6-FRUCTOSE DIPHOSPHATE (LINEAR FORM)A3ELF0.7
2FP1,6-FRUCTOSE DIPHOSPHATE (LINEAR FORM)A4ALD0.7
2FP1,6-FRUCTOSE DIPHOSPHATE (LINEAR FORM)A1UMG0.7
AFPALPHA FRUCTOSE 1,6-DIPHOSPHATEA,B1FBH0.94
AFPALPHA FRUCTOSE 1,6-DIPHOSPHATEA1LLC0.94
A5PARABINOSE-5-PHOSPHATEA1UJ60.8
A5PARABINOSE-5-PHOSPHATEA,B1FXQ0.8
A5PARABINOSE-5-PHOSPHATEA,B,C,D,E,F,
G,H,I,J,K,L
2NX30.8
A5PARABINOSE-5-PHOSPHATEA,B1LRQ0.8
A5PARABINOSE-5-PHOSPHATEA,B2CXP0.8
A5PARABINOSE-5-PHOSPHATEA,B1T8X0.8
A5PARABINOSE-5-PHOSPHATEA,B2EF90.8
A5PARABINOSE-5-PHOSPHATEA,B1FY60.8
A5PARABINOSE-5-PHOSPHATEA,B2NWS0.8
A5PARABINOSE-5-PHOSPHATEA,B2NXG0.8
A5PARABINOSE-5-PHOSPHATEA,B2A2I0.8
A5PARABINOSE-5-PHOSPHATEA,B1FWW0.8
3HD3-O-METHYL-O-ALPHA-D-MANNOPYRANOSYLA2HGO0.73
D6G2-DEOXY-GLUCOSE-6-PHOSPHATEA2PRI0.81
B1P2-DEOXY-5-O-PHOSPHONO-BETA-D-ERYTHRO-
PENTOFURANOSE
A2O7X0.8
B1P2-DEOXY-5-O-PHOSPHONO-BETA-D-ERYTHRO-
PENTOFURANOSE
A2HSR0.8
B1P2-DEOXY-5-O-PHOSPHONO-BETA-D-ERYTHRO-
PENTOFURANOSE
A2O820.8
B1P2-DEOXY-5-O-PHOSPHONO-BETA-D-ERYTHRO-
PENTOFURANOSE
A2O7Z0.8
B1P2-DEOXY-5-O-PHOSPHONO-BETA-D-ERYTHRO-
PENTOFURANOSE
A2HSS0.8
BGPBETA-GALACTOSE-6-PHOSPHATEA,B4PBG0.81
2IPD-MYO-INOSITOL-1,4-BISPHOSPHATEA1I9Z0.85
AAB2-DEOXY-5-PHOSPHORIBOSE GROUPA1A9J0.8
AAB2-DEOXY-5-PHOSPHORIBOSE GROUPC,D1MTL0.8
AAB2-DEOXY-5-PHOSPHORIBOSE GROUPB,C2OYT0.8
AAB2-DEOXY-5-PHOSPHORIBOSE GROUPA1G5E0.8
AAB2-DEOXY-5-PHOSPHORIBOSE GROUPD1MWI0.8
AAB2-DEOXY-5-PHOSPHORIBOSE GROUPA1A9I0.8
AAB2-DEOXY-5-PHOSPHORIBOSE GROUPA1GJ00.8
AAB2-DEOXY-5-PHOSPHORIBOSE GROUPB1SJL0.8
AAB2-DEOXY-5-PHOSPHORIBOSE GROUPA2SSP0.8
AAB2-DEOXY-5-PHOSPHORIBOSE GROUPA1A9G0.8
AAB2-DEOXY-5-PHOSPHORIBOSE GROUPA1A9H0.8
AHG2,5-ANHYDROGLUCITOL-1,6-BIPHOSPHATEA,B1FBD1
AHG2,5-ANHYDROGLUCITOL-1,6-BIPHOSPHATEA,B1FBE1
AHG2,5-ANHYDROGLUCITOL-1,6-BIPHOSPHATEA,B1FPE1
AHG2,5-ANHYDROGLUCITOL-1,6-BIPHOSPHATEA,B1FPD1
AHG2,5-ANHYDROGLUCITOL-1,6-BIPHOSPHATEA,B1FBC1
AHG2,5-ANHYDROGLUCITOL-1,6-BIPHOSPHATEA,B1FPG1
AHG2,5-ANHYDROGLUCITOL-1,6-BIPHOSPHATEA,B1FPL1
AHG2,5-ANHYDROGLUCITOL-1,6-BIPHOSPHATEA,B1FPI1
AHG2,5-ANHYDROGLUCITOL-1,6-BIPHOSPHATEA,B1FPJ1
AHG2,5-ANHYDROGLUCITOL-1,6-BIPHOSPHATEA,B1FPF1
CAK[(1R,2R,3S,4S,5R)-2,3,4,5-TETRAHYDROXYCYCLOHEXYL]METHYL DIHYDROGEN PHOSPHATEA,B2GRU0.71
BDFBETA-D-FRUCTOPYRANOSEA1OVP0.7
BDFBETA-D-FRUCTOPYRANOSEA,B1N3Q0.7
BDFBETA-D-FRUCTOPYRANOSEB2FA10.7
AHM2,5-ANHYDROMANNITOL-1,6-DIPHOSPHATEA,B1FBG1
AHM2,5-ANHYDROMANNITOL-1,6-DIPHOSPHATEA,B1FBF1
ABFBETA-D-ARABINOFURANOSE-5'-PHOSPHATEA,B,E,F1O8B0.82
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,B,F1OE50.87
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,B,C,D,E,F,
G,H,I,J,K,L
1Q9X0.87
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,B,C2NP70.87
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,D1PM50.87
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,B2OFI0.87
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,B,F1OE40.87
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEU,X1DE80.87
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,B1FZS0.87
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,C2NQ90.87
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,B,C,D,E,F2NP60.87
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATED1PHJ0.87
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,B,C2NQJ0.87
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,P,T2OZM0.87
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEC1N390.87
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEC1N3A0.87
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,B,V,Y1DE90.87
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,C2IH50.87
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,B,C,D,E,I2P5O0.87
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,B1FZL0.87
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,B,C,D,I2P5G0.87
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,B,C,D1M5R0.87
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,B,C1Y6F0.87
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,B1P5W0.87
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,D9MHT0.87
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,P,T3G6X0.87
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,P,T3G6V0.87
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,D1PJJ0.87
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,B1YCT0.87
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,P,T3G6Y0.87
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATED2RBA0.87
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATED1FN70.87
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEX1M060.87
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,B,C1P590.87
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEB,U,X1DEW0.87
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,B1HT40.87
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,C1QUM0.87
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,B1YCW0.87
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,B,C,D1IXY0.87
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,B,C1N480.87
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,C,E,F,I,J,K2OYQ0.87
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,F1OE60.87
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEE,G,I,K2DTU0.87
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,D,G,H1PH50.87
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,B1HT70.87
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,G3EI20.87
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,B,D,F1N560.87
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,B,C,D,E,F2IBT0.87
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,C,D2P660.87
A6P6-O-phosphono-alpha-D-allopyranoseA,B,C,D,E2VVO0.81
5IP(1R,2R,3R,4R,5S,6S)-6-HYDROXYCYCLOHEXANE-
1,2,3,4,5-PENTAYL PENTAKIS[DIHYDROGEN (PHOSPHATE)]
A2I5F0.8
ASO1,5-ANHYDROSORBITOLA1XIE0.74
ASO1,5-ANHYDROSORBITOLA3GUH0.74
ASO1,5-ANHYDROSORBITOLA,B2ASV0.74
ASO1,5-ANHYDROSORBITOLH,L2EC90.74