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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03169561

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
AOG4-AMINO-2-OCTYLOXY-6-HYDROXYMETHYL-
TETRAHYDRO-PYRAN-3,5-DIOL		A1R820.8
AD7octyl 3-amino-3-deoxy-2-O-(2,6-
dideoxy-alpha-L-lyxo-hexopyranosyl)-
beta-D-galactopyranoside		A2RJ90.76
AD7octyl 3-amino-3-deoxy-2-O-(2,6-
dideoxy-alpha-L-lyxo-hexopyranosyl)-
beta-D-galactopyranoside		A2RJ40.76
AS52-(acetylamino)-4-O-[2-(acetylamino)-
2-deoxy-alpha-L-gulopyranosyl]-
1,5-anhydro-2-deoxy-D-mannitol		A,B2VLC0.73
B6D2,4-bis(acetylamino)-2,4,6-trideoxy-
beta-D-glucopyranose		A2K330.72
B6D2,4-bis(acetylamino)-2,4,6-trideoxy-
beta-D-glucopyranose		A,B3FIR0.72
ABDACARBOSE DERIVED HEXASACCHARIDEA1QHO0.7
AGL4,6-DIDEOXY-4-AMINO-ALPHA-D-GLUCOSEA1CPU0.79
AGL4,6-DIDEOXY-4-AMINO-ALPHA-D-GLUCOSEA1NM90.79
AGL4,6-DIDEOXY-4-AMINO-ALPHA-D-GLUCOSEA1MFV0.79
AGL4,6-DIDEOXY-4-AMINO-ALPHA-D-GLUCOSEA1PIG0.79
AGL4,6-DIDEOXY-4-AMINO-ALPHA-D-GLUCOSEX1Z320.79
AGL4,6-DIDEOXY-4-AMINO-ALPHA-D-GLUCOSEA1MFU0.79
AGL4,6-DIDEOXY-4-AMINO-ALPHA-D-GLUCOSEA3BLK0.79
AGL4,6-DIDEOXY-4-AMINO-ALPHA-D-GLUCOSEX3BLP0.79
AGL4,6-DIDEOXY-4-AMINO-ALPHA-D-GLUCOSEA3DHP0.79
ABL6-HYDROXYMETHYL-5-(3,4,5-TRIHYDROXY-
6-HYDROXYMETHYL-TETRAHYDRO-PYRAN-
2-YLOXY)-PIPERIDINE-2,3,4-TRIOL		A,B1NAA0.78
ABL6-HYDROXYMETHYL-5-(3,4,5-TRIHYDROXY-
6-HYDROXYMETHYL-TETRAHYDRO-PYRAN-
2-YLOXY)-PIPERIDINE-2,3,4-TRIOL		A2AXR0.78
AGHN-{(1S,2R,3S)-1-[(ALPHA-D-GALACTOPYRANOSYLOXY)METHYL]-
2,3-DIHYDROXYHEPTADECYL}HEXACOSANAMIDE		A1ZT40.7
AGHN-{(1S,2R,3S)-1-[(ALPHA-D-GALACTOPYRANOSYLOXY)METHYL]-
2,3-DIHYDROXYHEPTADECYL}HEXACOSANAMIDE		A,C,E2PO60.7
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA,B,C,D2E510.74
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA1D0H0.74
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA1JOT0.74
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA1LLP0.74
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEX,Y2EAL0.74
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA,B1LU20.74
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA,B,C,E,F2J3F0.74
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA1LU10.74
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSED,E,F,G,H,I,
J,K,L,M		3EFX0.74
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA2VMC0.74
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA,B2W7Y0.74
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA1FNZ0.74
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA,B,C,D2W1U0.74
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEF2JHI0.74
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA,C,E,G1M260.74
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA,B,C,D2DTY0.74
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA,B2J1U0.74
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA2CCV0.74
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA2A2D0.74
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA2AYS0.74
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA,B,C,D2ZUT0.74
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA1KYJ0.74
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA,B2VNG0.74
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA,B2Z480.74
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSE1,2,31BCH0.74
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA2K330.74
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA2IXB0.74
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA,B1ULF0.74
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA,B1JLX0.74
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA1AX00.74
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA3CA30.74
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA,B,C,D1WMZ0.74
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA3CA60.74
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSED,E,G,H1LTI0.74
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEA,B,C,D2E7T0.74
A2GN-ACETYL-2-DEOXY-2-AMINO-GALACTOSEN,O,P,Q,R,S,
T,U,V,W		2O2L0.74
AMGALPHA-METHYL-D-GALACTOSIDEA,C,E,G1TP80.71
AMGALPHA-METHYL-D-GALACTOSIDEA,B,C,D1BXH0.71
AMGALPHA-METHYL-D-GALACTOSIDEA,C,E,G1WS40.71
AMGALPHA-METHYL-D-GALACTOSIDEA,B,C,D,E,F,
G,H		1FAY0.71
AMGALPHA-METHYL-D-GALACTOSIDEA3CA50.71
AMGALPHA-METHYL-D-GALACTOSIDEA,C,E,G1UH10.71
AMGALPHA-METHYL-D-GALACTOSIDEA,B1F9K0.71
AMGALPHA-METHYL-D-GALACTOSIDEA,B2Z490.71
AMGALPHA-METHYL-D-GALACTOSIDEA,C,E,G1TOQ0.71
AMGALPHA-METHYL-D-GALACTOSIDEA,B,C,D1WBL0.71
AMGALPHA-METHYL-D-GALACTOSIDEA,C,E,G1JAC0.71
1GN2-DEOXY-2-AMINOGALACTOSEA,B3GAL0.75
BGNN-BUTANOYL-2-AMINO-2-DEOXY-GLUCOPYRANOSIDEA,B,C,D1NWG0.73
B7GHEPTYL-BETA-D-GLUCOPYRANOSIDEA,B1Y0S0.72
B7GHEPTYL-BETA-D-GLUCOPYRANOSIDEA,B2B500.72
B7GHEPTYL-BETA-D-GLUCOPYRANOSIDEA,B2ZNP0.72
B7GHEPTYL-BETA-D-GLUCOPYRANOSIDEA,B2AWH0.72
B7GHEPTYL-BETA-D-GLUCOPYRANOSIDEA,B2ZNQ0.72
B7GHEPTYL-BETA-D-GLUCOPYRANOSIDEA3GZ90.72
B7GHEPTYL-BETA-D-GLUCOPYRANOSIDEA,D1QPF0.72
B7GHEPTYL-BETA-D-GLUCOPYRANOSIDEA,B2BAW0.72
9MR(3R,4R,5R)-3-HYDROXY-5-(HYDROXYMETHYL)PIPERIDIN-
4-YL BETA-D-GLUCOPYRANOSIDE		A3CUF0.76
9MR(3R,4R,5R)-3-HYDROXY-5-(HYDROXYMETHYL)PIPERIDIN-
4-YL BETA-D-GLUCOPYRANOSIDE		A,B2OYK0.76
BDGO-2,6-DIAMINO-2,6-DIDEOXY-ALPHA-
D-GLUCOPYRANOSE		A1QD30.76
BDGO-2,6-DIAMINO-2,6-DIDEOXY-ALPHA-
D-GLUCOPYRANOSE		B1O9M0.76
BDGO-2,6-DIAMINO-2,6-DIDEOXY-ALPHA-
D-GLUCOPYRANOSE		A1NEM0.76
AIG4-AMINO-2-HEXYLOXY-6-HYDROXYMETHYL-
TETRAHYDRO-PYRAN-3,5-DIOL		A1R7Y0.84
AIG4-AMINO-2-HEXYLOXY-6-HYDROXYMETHYL-
TETRAHYDRO-PYRAN-3,5-DIOL		A1R7X0.84
AIG4-AMINO-2-HEXYLOXY-6-HYDROXYMETHYL-
TETRAHYDRO-PYRAN-3,5-DIOL		A1R810.84
AIG4-AMINO-2-HEXYLOXY-6-HYDROXYMETHYL-
TETRAHYDRO-PYRAN-3,5-DIOL		A1R7V0.84
AIG4-AMINO-2-HEXYLOXY-6-HYDROXYMETHYL-
TETRAHYDRO-PYRAN-3,5-DIOL		A1R800.84
BM32-(ACETYLAMINO)-2-DEOXY-ALPHA-D-
MANNOPYRANOSE		A,B,C,D,E,F2J0G0.74
BM32-(ACETYLAMINO)-2-DEOXY-ALPHA-D-
MANNOPYRANOSE		A,B,C2ORJ0.74
BHG2-HEXYLOXY-6-HYDROXYMETHYL-TETRAHYDRO-
PYRAN-3,4,5-TRIOL		A,B,C,D1YQ30.75
BHG2-HEXYLOXY-6-HYDROXYMETHYL-TETRAHYDRO-
PYRAN-3,4,5-TRIOL		A1LZI0.75
BHG2-HEXYLOXY-6-HYDROXYMETHYL-TETRAHYDRO-
PYRAN-3,4,5-TRIOL		A,B,C,D,E,F,
G,N,O,P,Q,R,
S,T		1PP90.75
BHG2-HEXYLOXY-6-HYDROXYMETHYL-TETRAHYDRO-
PYRAN-3,4,5-TRIOL		A,B2GMH0.75
BHG2-HEXYLOXY-6-HYDROXYMETHYL-TETRAHYDRO-
PYRAN-3,4,5-TRIOL		A,B,C,D,E,F,
G,O,P,Q,R,S,T		1PPJ0.75
BHG2-HEXYLOXY-6-HYDROXYMETHYL-TETRAHYDRO-
PYRAN-3,4,5-TRIOL		A1WT10.75
BHG2-HEXYLOXY-6-HYDROXYMETHYL-TETRAHYDRO-
PYRAN-3,4,5-TRIOL		A1WT30.75
BHG2-HEXYLOXY-6-HYDROXYMETHYL-TETRAHYDRO-
PYRAN-3,4,5-TRIOL		A1LZJ0.75
BHG2-HEXYLOXY-6-HYDROXYMETHYL-TETRAHYDRO-
PYRAN-3,4,5-TRIOL		A,B,C,D,E,F,
G,I,N,O,P,Q,
R,S,T,U,V,W		2A060.75
BHG2-HEXYLOXY-6-HYDROXYMETHYL-TETRAHYDRO-
PYRAN-3,4,5-TRIOL		A,B,C,D,N,O,
P,Q		2FBW0.75
BHG2-HEXYLOXY-6-HYDROXYMETHYL-TETRAHYDRO-
PYRAN-3,4,5-TRIOL		A,B,C,D1YQ40.75
BHG2-HEXYLOXY-6-HYDROXYMETHYL-TETRAHYDRO-
PYRAN-3,4,5-TRIOL		A,B,C,D2H890.75
BHG2-HEXYLOXY-6-HYDROXYMETHYL-TETRAHYDRO-
PYRAN-3,4,5-TRIOL		A,B,C,D,N,O,
P,Q		2H880.75
AMVMETHYL 2-(ACETYLAMINO)-3-O-[(1R)-
1-CARBOXYETHYL]-2-DEOXY-BETA-D-
GLUCOPYRANOSIDE		A2J8G0.71
AMVMETHYL 2-(ACETYLAMINO)-3-O-[(1R)-
1-CARBOXYETHYL]-2-DEOXY-BETA-D-
GLUCOPYRANOSIDE		A2J8F0.71
9CS(1R,2S,3S,4R,6S)-4,6-DIAMINO-3-
[(3-AMINO-3-DEOXY-ALPHA-D-GLUCOPYRANOSYL)OXY]-
2-HYDROXYCYCLOHEXYL 2,6-DIAMINO-
2,6-DIDEOXY-ALPHA-D-GLUCOPYRANOSIDE		A2QIR0.7