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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02401224

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
GDA4-DEOXY-4-AMINO-BETA-D-GLUCOSEA,B1OCB0.81
AD7octyl 3-amino-3-deoxy-2-O-(2,6-
dideoxy-alpha-L-lyxo-hexopyranosyl)-
beta-D-galactopyranoside
A2RJ90.79
AD7octyl 3-amino-3-deoxy-2-O-(2,6-
dideoxy-alpha-L-lyxo-hexopyranosyl)-
beta-D-galactopyranoside
A2RJ40.79
GP4GLUCOSAMINE 4-PHOSPHATEA1FCP0.7
GP4GLUCOSAMINE 4-PHOSPHATEA,B,C1Q9W0.7
GP4GLUCOSAMINE 4-PHOSPHATEA2FCP0.7
GCSD-GLUCOSAMINEA3CO40.77
GCSD-GLUCOSAMINEA1QGI0.77
GCSD-GLUCOSAMINEA,B2VZS0.77
GCSD-GLUCOSAMINEA1E9L0.77
GCSD-GLUCOSAMINEA,B,C,D3FXI0.77
GCSD-GLUCOSAMINEA,B2VZV0.77
GP1GLUCOSAMINE 1-PHOSPHATEA,B,C1Q9W0.7
GP1GLUCOSAMINE 1-PHOSPHATEA,B2OI60.7
GP1GLUCOSAMINE 1-PHOSPHATEA2FCP0.7
GP1GLUCOSAMINE 1-PHOSPHATEA1FCP0.7
GP1GLUCOSAMINE 1-PHOSPHATEA1UJW0.7
AOG4-AMINO-2-OCTYLOXY-6-HYDROXYMETHYL-
TETRAHYDRO-PYRAN-3,5-DIOL
A1R820.83
AIG4-AMINO-2-HEXYLOXY-6-HYDROXYMETHYL-
TETRAHYDRO-PYRAN-3,5-DIOL
A1R7Y0.87
AIG4-AMINO-2-HEXYLOXY-6-HYDROXYMETHYL-
TETRAHYDRO-PYRAN-3,5-DIOL
A1R7X0.87
AIG4-AMINO-2-HEXYLOXY-6-HYDROXYMETHYL-
TETRAHYDRO-PYRAN-3,5-DIOL
A1R810.87
AIG4-AMINO-2-HEXYLOXY-6-HYDROXYMETHYL-
TETRAHYDRO-PYRAN-3,5-DIOL
A1R7V0.87
AIG4-AMINO-2-HEXYLOXY-6-HYDROXYMETHYL-
TETRAHYDRO-PYRAN-3,5-DIOL
A1R800.87
DAG4,6-DIDEOXY-4-AMINO-BETA-D-GLUCOPYRANOSIDEA2PIK0.82
DAG4,6-DIDEOXY-4-AMINO-BETA-D-GLUCOPYRANOSIDEA6CGT0.82
DAG4,6-DIDEOXY-4-AMINO-BETA-D-GLUCOPYRANOSIDEA,B1PIK0.82
BDGO-2,6-DIAMINO-2,6-DIDEOXY-ALPHA-
D-GLUCOPYRANOSE
A1QD30.78
BDGO-2,6-DIAMINO-2,6-DIDEOXY-ALPHA-
D-GLUCOPYRANOSE
B1O9M0.78
BDGO-2,6-DIAMINO-2,6-DIDEOXY-ALPHA-
D-GLUCOPYRANOSE
A1NEM0.78
GNSN-SULFO-ALPHA-D-GLUCOSAMINEA2ERM0.71
ABL6-HYDROXYMETHYL-5-(3,4,5-TRIHYDROXY-
6-HYDROXYMETHYL-TETRAHYDRO-PYRAN-
2-YLOXY)-PIPERIDINE-2,3,4-TRIOL
A,B1NAA0.72
ABL6-HYDROXYMETHYL-5-(3,4,5-TRIHYDROXY-
6-HYDROXYMETHYL-TETRAHYDRO-PYRAN-
2-YLOXY)-PIPERIDINE-2,3,4-TRIOL
A2AXR0.72
AGL4,6-DIDEOXY-4-AMINO-ALPHA-D-GLUCOSEA1CPU0.82
AGL4,6-DIDEOXY-4-AMINO-ALPHA-D-GLUCOSEA1NM90.82
AGL4,6-DIDEOXY-4-AMINO-ALPHA-D-GLUCOSEA1MFV0.82
AGL4,6-DIDEOXY-4-AMINO-ALPHA-D-GLUCOSEA1PIG0.82
AGL4,6-DIDEOXY-4-AMINO-ALPHA-D-GLUCOSEX1Z320.82
AGL4,6-DIDEOXY-4-AMINO-ALPHA-D-GLUCOSEA1MFU0.82
AGL4,6-DIDEOXY-4-AMINO-ALPHA-D-GLUCOSEA3BLK0.82
AGL4,6-DIDEOXY-4-AMINO-ALPHA-D-GLUCOSEX3BLP0.82
AGL4,6-DIDEOXY-4-AMINO-ALPHA-D-GLUCOSEA3DHP0.82
GLPGLUCOSAMINE 6-PHOSPHATEE,F,G,H,P,Q,
R,S
2NZ40.7
GLPGLUCOSAMINE 6-PHOSPHATEA1MOQ0.7
GLPGLUCOSAMINE 6-PHOSPHATEA3CXQ0.7
GLPGLUCOSAMINE 6-PHOSPHATEA,B3B4A0.7
GLPGLUCOSAMINE 6-PHOSPHATEA,B3B4C0.7
GLPGLUCOSAMINE 6-PHOSPHATEA,B3B4B0.7
GLPGLUCOSAMINE 6-PHOSPHATEA,B2VHL0.7
GLPGLUCOSAMINE 6-PHOSPHATEA,B2Z750.7
GLPGLUCOSAMINE 6-PHOSPHATEX2VF50.7
GLPGLUCOSAMINE 6-PHOSPHATEA,B2RI10.7
B19N-{[(3AS,5AR,8AR,8BS)-2,2,7,7-TETRAMETHYLTETRAHYDRO-
3AH-BIS[1,3]DIOXOLO[4,5-B:4',5'-
D]PYRAN-3A-YL]METHYL}SULFAMIDE
A2H150.75
AR42-AMINO-5-(3-FLUORO-3,4-DIHYDROXY-
5-HYDROXYMETHYL-TETRAHYDRO-FURAN-
2-YLOXY)-5-HYDROXY-PENTANOIC ACID
A,B,C1S2D0.71
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
A2QIR0.73
EAG2-aminoethyl 2-(acetylamino)-2-
deoxy-beta-D-glucopyranoside
B,D,E,F,H3BZ40.7
GCN3-DEOXY-D-GLUCOSAMINEA1FI10.77
GCN3-DEOXY-D-GLUCOSAMINEA1QFG0.77
GCN3-DEOXY-D-GLUCOSAMINEA1QKC0.77
GCN3-DEOXY-D-GLUCOSAMINEA,B2GRX0.77
GCN3-DEOXY-D-GLUCOSAMINEA1QJQ0.77
GCN3-DEOXY-D-GLUCOSAMINEA1QFF0.77
IDGO-2,6-DIAMINO-2,6-DIDEOXY-BETA-
L-IDOPYRANOSE
A1QD30.78
IDGO-2,6-DIAMINO-2,6-DIDEOXY-BETA-
L-IDOPYRANOSE
A1NEM0.78
IDGO-2,6-DIAMINO-2,6-DIDEOXY-BETA-
L-IDOPYRANOSE
A1PBR0.78
1GN2-DEOXY-2-AMINOGALACTOSEA,B3GAL0.77