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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02865355

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
ABFBETA-D-ARABINOFURANOSE-5'-PHOSPHATEA,B,E,F1O8B0.72
DRZ3',4'-DIHYDROXY-PENTANAL-5'-PHOSPHATEA,C1M3Q0.72
AAB2-DEOXY-5-PHOSPHORIBOSE GROUPA1A9J0.74
AAB2-DEOXY-5-PHOSPHORIBOSE GROUPC,D1MTL0.74
AAB2-DEOXY-5-PHOSPHORIBOSE GROUPB,C2OYT0.74
AAB2-DEOXY-5-PHOSPHORIBOSE GROUPA1G5E0.74
AAB2-DEOXY-5-PHOSPHORIBOSE GROUPD1MWI0.74
AAB2-DEOXY-5-PHOSPHORIBOSE GROUPA1A9I0.74
AAB2-DEOXY-5-PHOSPHORIBOSE GROUPA1GJ00.74
AAB2-DEOXY-5-PHOSPHORIBOSE GROUPB1SJL0.74
AAB2-DEOXY-5-PHOSPHORIBOSE GROUPA2SSP0.74
AAB2-DEOXY-5-PHOSPHORIBOSE GROUPA1A9G0.74
AAB2-DEOXY-5-PHOSPHORIBOSE GROUPA1A9H0.74
EIP4-HYDROXY-3-METHYL BUTYL DIPHOSPHATEA,B1NFZ0.7
EIP4-HYDROXY-3-METHYL BUTYL DIPHOSPHATEA,B1PPW0.7
EIP4-HYDROXY-3-METHYL BUTYL DIPHOSPHATEA,B2B2K0.7
EIP4-HYDROXY-3-METHYL BUTYL DIPHOSPHATEA,B1OW20.7
EIP4-HYDROXY-3-METHYL BUTYL DIPHOSPHATEA,B2G730.7
5IP(1R,2R,3R,4R,5S,6S)-6-HYDROXYCYCLOHEXANE-
1,2,3,4,5-PENTAYL PENTAKIS[DIHYDROGEN (PHOSPHATE)]
A2I5F0.74
1GPSN-GLYCEROL-1-PHOSPHATEA,B2F6X0.83
1GPSN-GLYCEROL-1-PHOSPHATEA,B,C,D2VYV0.83
4IPINOSITOL-(1,3,4,5)-TETRAKISPHOSPHATEA1U270.74
4IPINOSITOL-(1,3,4,5)-TETRAKISPHOSPHATEA1FAO0.74
4IPINOSITOL-(1,3,4,5)-TETRAKISPHOSPHATEA2UZS0.74
4IPINOSITOL-(1,3,4,5)-TETRAKISPHOSPHATEA1H100.74
4IPINOSITOL-(1,3,4,5)-TETRAKISPHOSPHATEA,B2R0D0.74
4IPINOSITOL-(1,3,4,5)-TETRAKISPHOSPHATEA,B1B550.74
4IPINOSITOL-(1,3,4,5)-TETRAKISPHOSPHATEA1W1D0.74
4IPINOSITOL-(1,3,4,5)-TETRAKISPHOSPHATEA,B1BWN0.74
4IPINOSITOL-(1,3,4,5)-TETRAKISPHOSPHATEA,B1W2D0.74
4IPINOSITOL-(1,3,4,5)-TETRAKISPHOSPHATEA,B1FHX0.74
4IPINOSITOL-(1,3,4,5)-TETRAKISPHOSPHATEA,B2R090.74
4IPINOSITOL-(1,3,4,5)-TETRAKISPHOSPHATEA1UNQ0.74
4IPINOSITOL-(1,3,4,5)-TETRAKISPHOSPHATEA1UPR0.74
4IPINOSITOL-(1,3,4,5)-TETRAKISPHOSPHATEA1FGY0.74
2IPD-MYO-INOSITOL-1,4-BISPHOSPHATEA1I9Z0.79
CDI2C-METHYL-D-ERYTHRITOL 2,4-CYCLODIPHOSPHATEA1KNJ0.79
CDI2C-METHYL-D-ERYTHRITOL 2,4-CYCLODIPHOSPHATEA,B,C,D,E,F,
G,H
1H480.79
CDI2C-METHYL-D-ERYTHRITOL 2,4-CYCLODIPHOSPHATEA1JY80.79
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,B,F1OE50.8
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,B,C,D,E,F,
G,H,I,J,K,L
1Q9X0.8
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,B,C2NP70.8
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,D1PM50.8
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,B2OFI0.8
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,B,F1OE40.8
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEU,X1DE80.8
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,B1FZS0.8
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,C2NQ90.8
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,B,C,D,E,F2NP60.8
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATED1PHJ0.8
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,B,C2NQJ0.8
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,P,T2OZM0.8
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEC1N390.8
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEC1N3A0.8
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,B,V,Y1DE90.8
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,C2IH50.8
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,B,C,D,E,I2P5O0.8
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,B1FZL0.8
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,B,C,D,I2P5G0.8
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,B,C,D1M5R0.8
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,B,C1Y6F0.8
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,B1P5W0.8
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,D9MHT0.8
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,P,T3G6X0.8
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,P,T3G6V0.8
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,D1PJJ0.8
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,B1YCT0.8
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,P,T3G6Y0.8
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATED2RBA0.8
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATED1FN70.8
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEX1M060.8
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,B,C1P590.8
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEB,U,X1DEW0.8
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,B1HT40.8
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,C1QUM0.8
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,B1YCW0.8
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,B,C,D1IXY0.8
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,B,C1N480.8
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,C,E,F,I,J,K2OYQ0.8
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,F1OE60.8
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEE,G,I,K2DTU0.8
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,D,G,H1PH50.8
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,B1HT70.8
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,G3EI20.8
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,B,D,F1N560.8
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,B,C,D,E,F2IBT0.8
3DR1',2'-DIDEOXYRIBOFURANOSE-5'-PHOSPHATEA,C,D2P660.8
F1P1-O-PHOSPHONO-BETA-D-FRUCTOPYRANOSEA,B2DF80.71
DX5D-XYLITOL-5-PHOSPHATEA,B,C,D,E,F,
G,H,I,J,K,L
2FLI0.92
AHM2,5-ANHYDROMANNITOL-1,6-DIPHOSPHATEA,B1FBG0.74
AHM2,5-ANHYDROMANNITOL-1,6-DIPHOSPHATEA,B1FBF0.74
DXP1-DEOXY-D-XYLULOSE-5-PHOSPHATEB,C,D,E,F,G,H3GK00.76
DXP1-DEOXY-D-XYLULOSE-5-PHOSPHATEA,B,C,E,F,G1M5W0.76
DXP1-DEOXY-D-XYLULOSE-5-PHOSPHATEA,B,C,D1IXN0.76
DXP1-DEOXY-D-XYLULOSE-5-PHOSPHATEA,B1Q0Q0.76
5RPRIBULOSE-5-PHOSPHATEA,B1XBY0.72
5RPRIBULOSE-5-PHOSPHATEA,B1XBX0.72
5RPRIBULOSE-5-PHOSPHATEA1UJ50.72
5RPRIBULOSE-5-PHOSPHATEA,B1PVY0.72
5RPRIBULOSE-5-PHOSPHATEA2RIU0.72
5RPRIBULOSE-5-PHOSPHATEA,B1SNN0.72
5RPRIBULOSE-5-PHOSPHATEA,B1TKU0.72
5RPRIBULOSE-5-PHOSPHATEA,B3HHE0.72
5RPRIBULOSE-5-PHOSPHATEA,B1XBV0.72
5RPRIBULOSE-5-PHOSPHATEA,B,C2ISS0.72
5RPRIBULOSE-5-PHOSPHATEA,B,C2IYP0.72
5RPRIBULOSE-5-PHOSPHATEA,B,C,D,E2VVP0.72
B1P2-DEOXY-5-O-PHOSPHONO-BETA-D-ERYTHRO-
PENTOFURANOSE
A2O7X0.74
B1P2-DEOXY-5-O-PHOSPHONO-BETA-D-ERYTHRO-
PENTOFURANOSE
A2HSR0.74
B1P2-DEOXY-5-O-PHOSPHONO-BETA-D-ERYTHRO-
PENTOFURANOSE
A2O820.74
B1P2-DEOXY-5-O-PHOSPHONO-BETA-D-ERYTHRO-
PENTOFURANOSE
A2O7Z0.74
B1P2-DEOXY-5-O-PHOSPHONO-BETA-D-ERYTHRO-
PENTOFURANOSE
A2HSS0.74
DG62-DEOXY-GLUCITOL-6-PHOSPHATEA,B1JKI0.85
DTLD-TREITOLA1H160.74
DTLD-TREITOLA1H170.74
DTLD-TREITOLA,C2AAW0.74
DTLD-TREITOLA,B1H180.74
A5PARABINOSE-5-PHOSPHATEA1UJ60.92
A5PARABINOSE-5-PHOSPHATEA,B1FXQ0.92
A5PARABINOSE-5-PHOSPHATEA,B,C,D,E,F,
G,H,I,J,K,L
2NX30.92
A5PARABINOSE-5-PHOSPHATEA,B1LRQ0.92
A5PARABINOSE-5-PHOSPHATEA,B2CXP0.92
A5PARABINOSE-5-PHOSPHATEA,B1T8X0.92
A5PARABINOSE-5-PHOSPHATEA,B2EF90.92
A5PARABINOSE-5-PHOSPHATEA,B1FY60.92
A5PARABINOSE-5-PHOSPHATEA,B2NWS0.92
A5PARABINOSE-5-PHOSPHATEA,B2NXG0.92
A5PARABINOSE-5-PHOSPHATEA,B2A2I0.92
A5PARABINOSE-5-PHOSPHATEA,B1FWW0.92
AHG2,5-ANHYDROGLUCITOL-1,6-BIPHOSPHATEA,B1FBD0.74
AHG2,5-ANHYDROGLUCITOL-1,6-BIPHOSPHATEA,B1FBE0.74
AHG2,5-ANHYDROGLUCITOL-1,6-BIPHOSPHATEA,B1FPE0.74
AHG2,5-ANHYDROGLUCITOL-1,6-BIPHOSPHATEA,B1FPD0.74
AHG2,5-ANHYDROGLUCITOL-1,6-BIPHOSPHATEA,B1FBC0.74
AHG2,5-ANHYDROGLUCITOL-1,6-BIPHOSPHATEA,B1FPG0.74
AHG2,5-ANHYDROGLUCITOL-1,6-BIPHOSPHATEA,B1FPL0.74
AHG2,5-ANHYDROGLUCITOL-1,6-BIPHOSPHATEA,B1FPI0.74
AHG2,5-ANHYDROGLUCITOL-1,6-BIPHOSPHATEA,B1FPJ0.74
AHG2,5-ANHYDROGLUCITOL-1,6-BIPHOSPHATEA,B1FPF0.74