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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs01727569

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
GM2N-[(1S,2S)-2-HYDROXY-1-({[(2R,3R,4S,5S,6R)-
3,4,5-TRIHYDROXY-6-(HYDROXYMETHYL)TETRAHYDRO-
2H-PYRAN-2-YL]OXY}METHYL)OCTADECYL]OCTADECANAMIDE
A1GZP0.75
AGHN-{(1S,2R,3S)-1-[(ALPHA-D-GALACTOPYRANOSYLOXY)METHYL]-
2,3-DIHYDROXYHEPTADECYL}HEXACOSANAMIDE
A1ZT40.75
AGHN-{(1S,2R,3S)-1-[(ALPHA-D-GALACTOPYRANOSYLOXY)METHYL]-
2,3-DIHYDROXYHEPTADECYL}HEXACOSANAMIDE
A,C,E2PO60.75
CTYCLARITHROMYCINA1J5A0.95
PXI4-{[4-(DIMETHYLAMINO)-3-HYDROXY-
6-METHYLTETRAHYDRO-2H-PYRAN-2-YL]OXY}-
12-ETHYL-3,5,7,11-TETRAMETHYLOXACYCLODODEC-
9-ENE-2,8-DIONE
A,B2C6H0.76
PXI4-{[4-(DIMETHYLAMINO)-3-HYDROXY-
6-METHYLTETRAHYDRO-2H-PYRAN-2-YL]OXY}-
12-ETHYL-3,5,7,11-TETRAMETHYLOXACYCLODODEC-
9-ENE-2,8-DIONE
A,B2CA00.76
PXI4-{[4-(DIMETHYLAMINO)-3-HYDROXY-
6-METHYLTETRAHYDRO-2H-PYRAN-2-YL]OXY}-
12-ETHYL-3,5,7,11-TETRAMETHYLOXACYCLODODEC-
9-ENE-2,8-DIONE
A,B2CD80.76
PXI4-{[4-(DIMETHYLAMINO)-3-HYDROXY-
6-METHYLTETRAHYDRO-2H-PYRAN-2-YL]OXY}-
12-ETHYL-3,5,7,11-TETRAMETHYLOXACYCLODODEC-
9-ENE-2,8-DIONE
A,B2VZ70.76
DH9(2S,3S,5S)-5-[(N-FORMYL-L-LEUCYL)OXY]-
2-HEXYL-3-HYDROXYHEXADECANOIC ACID
A,B2PX60.74
GTH3-O-GLUCOPYRANOSYL-THREONINE-[2-
DEOXY-2-ACETAMIDO-GLUCOPYRANOSIDE]
A1WCT0.71
QPU1,5-anhydro-4-O-(4,6-dideoxy-4-
{[(1S,2S,3S,4R,5S,6R)-2,3,4,6-tetrahydroxy-
5-methylcyclohexyl]amino}-alpha-
D-glucopyranosyl)-D-glucitol
A,B,C2QPU0.73
NRBNARBOMYCINA,B2VZM0.74
NRBNARBOMYCINA2C7X0.74
GSL(2S,3R)-3-HYDROXY-2-(TETRADECANOYLAMINO)OCTADECYL ALPHA-
D-GALACTOPYRANOSIDURONIC ACID
A2FIK0.79
ERNA2O430.92
ERYERYTHROMYCIN AA,B2IYF0.95
ERYERYTHROMYCIN AA,B3FRQ0.95
ERYERYTHROMYCIN A0,1,2,3,9,A,
B,C,H,J,K,L,
M,N,O,Q,R,S,
T,U,Y,Z
1YI20.95
ERYERYTHROMYCIN AA,B2J0D0.95
ERYERYTHROMYCIN AA1JZY0.95
CAICARBOMYCIN A1,2,4,A,B,C,
D,E,J,K,L,M,
N,O,P,R,S,T,
U,V,Z
1K8A0.75
A164-O-(4,6-dideoxy-4-{[(1S,2S,3S,4R,5S)-
2,3,4-trihydroxy-5-(hydroxymethyl)cyclohexyl]amino}-
alpha-D-glucopyranosyl)-beta-D-
glucopyranose
A,B2VR50.73
LP5(R)-((2R,3S,4R,5R,6R)-3-HYDROXY-
2-(HYDROXYMETHYL)-5-((R)-3-HYDROXYTETRADECANAMIDO)-
6-(PHOSPHONOOXY)TETRAHYDRO-2H-PYRAN-
4-YL) 3-HYDROXYTETRADECANOATE
A2E590.71
JOSA2O440.77
PBS(2S,3S,4R)-N-OCTANOYL-1-[(ALPHA-
D-GALACTOPYRANOSYL)OXY]-2-AMINO-
OCTADECANE-3,4-DIOL
A,C1Z5L0.75
GM3N-{1-[(HEXOPYRANOSYLOXY)METHYL]-
2-HYDROXYNONADECYL}TETRACOSANAMIDE
A2BV70.75
GETGENETICINA1MWL0.71
GETGENETICINA,B,C,D1NJJ0.71
ROXROXITHROMYCINA1JZZ0.86
GACDIHYDRO-ACARBOSEA1GAI0.71