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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03927412

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
I5PINOSITOL-(1,3,4,5,6)-PENTAKISPHOSPHATEA,B1FHW0.8
I2PD-MYO-INOSITOL-2,4,5-TRIPHOSPHATEA,B1DJY0.86
LIPL-MYO-INOSITOL-1-PHOSPHATEA,B1IMB0.83
LIPL-MYO-INOSITOL-1-PHOSPHATEA,B3C4V0.83
P25PENTYL TRIHYDROGEN DIPHOSPHATEA,B1T9B0.7
P25PENTYL TRIHYDROGEN DIPHOSPHATEA,B,C,D1T9D0.7
M2PD-MANNITOL-1,6-DIPHOSPHATEA2Q8J0.79
M2PD-MANNITOL-1,6-DIPHOSPHATEA,B,C,D2QDH0.79
M2PD-MANNITOL-1,6-DIPHOSPHATEA,B,C,D1ZAJ0.79
IBSL-ALPHA-GLYCEROPHOSPHO-D-MYO-INOSITOL-
4,5-BIS-PHOSPHATE		A1I7E0.72
S6PD-SORBITOL-6-PHOSPHATEA,B2CXQ0.79
S6PD-SORBITOL-6-PHOSPHATEA,B1XTB0.79
S6PD-SORBITOL-6-PHOSPHATEA,B2GC10.79
S6PD-SORBITOL-6-PHOSPHATEA,B,C,D,E,F3CTL0.79
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
DG62-DEOXY-GLUCITOL-6-PHOSPHATEA,B1JKI0.79
IP2D-MYO-INOSITOL-4,5-BISPHOSPHATEA1HG20.86
IP2D-MYO-INOSITOL-4,5-BISPHOSPHATEA,B1DJZ0.86
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
2IPD-MYO-INOSITOL-1,4-BISPHOSPHATEA1I9Z0.86
CAK[(1R,2R,3S,4S,5R)-2,3,4,5-TETRAHYDROXYCYCLOHEXYL]METHYL DIHYDROGEN PHOSPHATEA,B2GRU0.7
XDPD-XYLULOSE-2,2-DIOL-1,5-BISPHOSPHATEB,E,H,K,L,O,
R,V		1RCO0.72
IPDD-MYO-INOSITOL-1-PHOSPHATEA,B1IMA0.83
IPDD-MYO-INOSITOL-1-PHOSPHATEA,B1G0H0.83
IPDD-MYO-INOSITOL-1-PHOSPHATEA,B,C2ORK0.83
IPDD-MYO-INOSITOL-1-PHOSPHATEA,B1AWB0.83
IPDD-MYO-INOSITOL-1-PHOSPHATEA,B1LBX0.83
I3S(1S,3S,4S)-1,3,4-TRIPHOSPHO-MYO-
INOSITOL		X1Z2P0.86
I3S(1S,3S,4S)-1,3,4-TRIPHOSPHO-MYO-
INOSITOL		A2P0H0.86
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
I3PD-MYO-INOSITOL-1,4,5-TRIPHOSPHATEA1H0A0.86
I3PD-MYO-INOSITOL-1,4,5-TRIPHOSPHATEA1NU20.86
I3PD-MYO-INOSITOL-1,4,5-TRIPHOSPHATEA1GC60.86
I3PD-MYO-INOSITOL-1,4,5-TRIPHOSPHATEA1MAI0.86
I3PD-MYO-INOSITOL-1,4,5-TRIPHOSPHATEA2P0D0.86
I3PD-MYO-INOSITOL-1,4,5-TRIPHOSPHATEA,B1OQN0.86
I3PD-MYO-INOSITOL-1,4,5-TRIPHOSPHATEA1U290.86
I3PD-MYO-INOSITOL-1,4,5-TRIPHOSPHATEA,B1W2C0.86
I3PD-MYO-INOSITOL-1,4,5-TRIPHOSPHATEA,B1DJX0.86
I3PD-MYO-INOSITOL-1,4,5-TRIPHOSPHATEA2A980.86
I3PD-MYO-INOSITOL-1,4,5-TRIPHOSPHATEA1N4K0.86
I3PD-MYO-INOSITOL-1,4,5-TRIPHOSPHATEA,B3C5N0.86
I3PD-MYO-INOSITOL-1,4,5-TRIPHOSPHATEA1BTN0.86
DX5D-XYLITOL-5-PHOSPHATEA,B,C,D,E,F,
G,H,I,J,K,L		2FLI0.71
ITPPHOSPHORIC ACID MONO-(2,3,4,6-TETRAHYDROXY-
5-PHOSPHONOOXY-CYCLOHEXYL) ESTER		A,B1JOC0.86
ITPPHOSPHORIC ACID MONO-(2,3,4,6-TETRAHYDROXY-
5-PHOSPHONOOXY-CYCLOHEXYL) ESTER		A1HYI0.86
I4P(1S,3R,4R,6S)-1,3,4,6-TETRAPKISPHOSPHATEX1Z2O0.8
LXPL-XYLITOL 5-PHOSPHATEA,B1Q6Q0.71
AHG2,5-ANHYDROGLUCITOL-1,6-BIPHOSPHATEA,B1FBD0.72
AHG2,5-ANHYDROGLUCITOL-1,6-BIPHOSPHATEA,B1FBE0.72
AHG2,5-ANHYDROGLUCITOL-1,6-BIPHOSPHATEA,B1FPE0.72
AHG2,5-ANHYDROGLUCITOL-1,6-BIPHOSPHATEA,B1FPD0.72
AHG2,5-ANHYDROGLUCITOL-1,6-BIPHOSPHATEA,B1FBC0.72
AHG2,5-ANHYDROGLUCITOL-1,6-BIPHOSPHATEA,B1FPG0.72
AHG2,5-ANHYDROGLUCITOL-1,6-BIPHOSPHATEA,B1FPL0.72
AHG2,5-ANHYDROGLUCITOL-1,6-BIPHOSPHATEA,B1FPI0.72
AHG2,5-ANHYDROGLUCITOL-1,6-BIPHOSPHATEA,B1FPJ0.72
AHG2,5-ANHYDROGLUCITOL-1,6-BIPHOSPHATEA,B1FPF0.72
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		2QJG0.79
F2P1,6-DI-O-PHOSPHONO-D-ALLITOLA,B,C,D,E,F,
G,H,I,J		1W8R0.79
IHPINOSITOL HEXAKISPHOSPHATEB,E2P1N0.88
IHPINOSITOL HEXAKISPHOSPHATEA,B1ZY70.88
IHPINOSITOL HEXAKISPHOSPHATEB3C6P0.88
IHPINOSITOL HEXAKISPHOSPHATEB2P1P0.88
IHPINOSITOL HEXAKISPHOSPHATEA2Q9P0.88
IHPINOSITOL HEXAKISPHOSPHATEA,B3HO60.88
IHPINOSITOL HEXAKISPHOSPHATEA1ZSH0.88
IHPINOSITOL HEXAKISPHOSPHATEB3C6N0.88
IHPINOSITOL HEXAKISPHOSPHATEB2P1M0.88
IHPINOSITOL HEXAKISPHOSPHATEB2P1O0.88
IHPINOSITOL HEXAKISPHOSPHATEA1DKP0.88
IHPINOSITOL HEXAKISPHOSPHATEA1DKQ0.88
IHPINOSITOL HEXAKISPHOSPHATEA2VGL0.88
IHPINOSITOL HEXAKISPHOSPHATEA,B,C,D1THB0.88
IHPINOSITOL HEXAKISPHOSPHATEA,B3EEB0.88
IHPINOSITOL HEXAKISPHOSPHATEA,B3FZY0.88
IHPINOSITOL HEXAKISPHOSPHATEB2P1Q0.88
IHPINOSITOL HEXAKISPHOSPHATEA,B,C,D1NIH0.88
IHPINOSITOL HEXAKISPHOSPHATEA2FVV0.88
IHPINOSITOL HEXAKISPHOSPHATEA,B,C,D3GCD0.88
IHPINOSITOL HEXAKISPHOSPHATEA,B,C,D1BQ30.88
IHPINOSITOL HEXAKISPHOSPHATEA1HG50.88
IHPINOSITOL HEXAKISPHOSPHATEB3C6O0.88
IP5(1R,2S,3R,4S,5S,6R)-6-HYDROXYCYCLOHEXANE-
1,2,3,4,5-PENTAYL PENTAKIS[DIHYDROGEN (PHOSPHATE)]		A,B,C2I5C0.8
AHM2,5-ANHYDROMANNITOL-1,6-DIPHOSPHATEA,B1FBG0.72
AHM2,5-ANHYDROMANNITOL-1,6-DIPHOSPHATEA,B1FBF0.72
FPCD-FRUCTOSE-6-PHOSPHATE (OPEN FORM)A,B1FQO0.79
FPCD-FRUCTOSE-6-PHOSPHATE (OPEN FORM)A,B2GC20.79
5IP(1R,2R,3R,4R,5S,6S)-6-HYDROXYCYCLOHEXANE-
1,2,3,4,5-PENTAYL PENTAKIS[DIHYDROGEN (PHOSPHATE)]		A2I5F0.8