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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03260470

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
2FG2-FLUORO-2-DEOXY-BETA-D-GALACTOPYRANOSEI,J,K,L,M,N,
O,P
1JZ10.86
2FG2-FLUORO-2-DEOXY-BETA-D-GALACTOPYRANOSEA,B,C,D,E,F,
G,H
1JZ00.86
2FG2-FLUORO-2-DEOXY-BETA-D-GALACTOPYRANOSEA,B,C,D1JZ20.86
0BD3-methyl-1-(2-methylpropyl)butyl 4-
O-beta-L-gulopyranosyl-beta-D-glucopyranoside
A,B3FQQ0.82
293(2S,4R,5S,6R)-6-((S)-1,2-dihydroxyethyl)tetrahydro-
2H-pyran-2,4,5-triol
A,B,C2RIE0.79
ABEABEQUOSEH,L1MFE0.81
ABEABEQUOSEH1MFA0.81
ABEABEQUOSEA,B,C2J600.81
ABEABEQUOSEH1MFC0.81
ABEABEQUOSEH1MFD0.81
ABEABEQUOSEH1MFB0.81
ABEABEQUOSEA1TYX0.81
2FL2-FLUORO-2-DEOXY-LACTOSEI,J,K,L,M,N,
O,P
1JYZ1
2FL2-FLUORO-2-DEOXY-LACTOSEA,B,C,D,E,F,
G,H
1JYY1
A6P6-O-phosphono-alpha-D-allopyranoseA,B,C,D,E2VVO0.75
10Mdecyl 4-O-alpha-D-glucopyranosyl-
1-thio-beta-D-glucopyranoside
A3C5T0.75
10Mdecyl 4-O-alpha-D-glucopyranosyl-
1-thio-beta-D-glucopyranoside
A,B3C590.75
2GS2-O-METHYL-ALPHA-D-GALACTOPYRANOSEA,B,C,D2DTW0.83
3FM3-O-FORMAMIDO-ALPHA-D-MANNOPYRANOSIDEA1AO40.7
3HD3-O-METHYL-O-ALPHA-D-MANNOPYRANOSYLA2HGO0.71
3MG3-O-methyl-beta-D-glucopyranoseA2QW10.81
46M(4AR,6R,7S,8R,8AS)-HEXAHYDRO-6,7,8-
TRIHYDROXY-2-METHYLPYRANO[3,2-D][1,3]DIOXINE-
2-CARBOXYLIC ACID
A1X1I0.77
289D-glycero-alpha-D-manno-heptopyranoseA,B,C2RIA0.79
AD0DIGALACTURONIC ACIDA,B2UVF0.73
3CM3-CYCLOHEXYLPROPYL 4-O-ALPHA-D-
GLUCOPYRANOSYL-BETA-D-GLUCOPYRANOSIDE
A,B2HZA0.78
2DG2-DEOXY-BETA-D-GALACTOSEA,B,C,D1JZ30.82
2DG2-DEOXY-BETA-D-GALACTOSEA,B,C,D1JZ40.82
1GL4-O-METHYL-2,6-DIDEOXY-ALPHA-D-
GALACTO-HEXOPYRANOSE
A,B,C,D1VAQ0.81
1GL4-O-METHYL-2,6-DIDEOXY-ALPHA-D-
GALACTO-HEXOPYRANOSE
A,B1EKH0.81
1GL4-O-METHYL-2,6-DIDEOXY-ALPHA-D-
GALACTO-HEXOPYRANOSE
A,B1EKI0.81
1GL4-O-METHYL-2,6-DIDEOXY-ALPHA-D-
GALACTO-HEXOPYRANOSE
A,B1D830.81
2GL4-O-ACETYL-2,6-DIDEOXY-ALPHA-D-
GALACTO-HEXOPYRANOSE
A,B1EKH0.77
2GL4-O-ACETYL-2,6-DIDEOXY-ALPHA-D-
GALACTO-HEXOPYRANOSE
A,B1EKI0.77
ACXALPHA-CYCLODEXTRIN (CYCLOHEXA-AMYLOSE)A1CXF0.8
ACXALPHA-CYCLODEXTRIN (CYCLOHEXA-AMYLOSE)A,B,C,D3CK70.8
ACXALPHA-CYCLODEXTRIN (CYCLOHEXA-AMYLOSE)A2ZYM0.8
ACXALPHA-CYCLODEXTRIN (CYCLOHEXA-AMYLOSE)A,B3EDD0.8
ACXALPHA-CYCLODEXTRIN (CYCLOHEXA-AMYLOSE)A3BCD0.8
ACXALPHA-CYCLODEXTRIN (CYCLOHEXA-AMYLOSE)A,B3EDF0.8
AAL3,6-ANHYDRO-L-GALACTOSEA,B,C,D2CDO0.76
AAL3,6-ANHYDRO-L-GALACTOSEA,B1AGA0.76
AAL3,6-ANHYDRO-L-GALACTOSEA,B,C,D2CDP0.76
AAL3,6-ANHYDRO-L-GALACTOSEA1URX0.76