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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03504335

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
PULA2C780.76
SCGMETHYL (2S,3R,4S)-2-(BETA-D-GLUCOPYRANOSYLOXY)-
4-(2-OXOETHYL)-3-VINYL-3,4-DIHYDRO-
2H-PYRAN-5-CARBOXYLATE
A,B2FPC0.7
E4H(3R,4S,5S,7R,9E,11R,12R)-12-ETHYL-
4-HYDROXY-3,5,7,11-TETRAMETHYLOXACYCLODODEC-
9-ENE-2,8-DIONE
A,B2HFK0.71
TSO(1R,3S,5S,8R)-8-HYDROXY-2-OXABICYCLO[3.3.1]NON-
6-ENE-3,5-DICARBOXYLIC ACID
A,B,C,D2W1A0.71
GR4H,I1AWF0.74
E7BA,B3E7B0.71
MRCMUPIROCINA1JZS0.7
MRCMUPIROCINA,T1FFY0.7
MRCMUPIROCINA1QU30.7
MRCMUPIROCINA,T1QU20.7
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,B2C6H0.73
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,B2CA00.73
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,B2CD80.73
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,B2VZ70.73
GMMGLUCOSE MONOMYCOLATEA1UQS0.75
NRBNARBOMYCINA,B2VZM0.73
NRBNARBOMYCINA2C7X0.73
GGDNONADEC-10-ENOIC ACID 2-[3,4-DIHYDROXY-
6-HYDROXYMETHYL-5-(3,4,5-TRIHYDROXY-
6-HYDROXYMETHYL-TETRAHYDRO-PYRAN-
2-YLOXY)-TETRAHYDRO-PYRAN-2-YLOXY]-
1-OCTADEC-9-ENOYLOXYMETHYL-ETHYL ESTER
H,L,M2J8C0.73
GGDNONADEC-10-ENOIC ACID 2-[3,4-DIHYDROXY-
6-HYDROXYMETHYL-5-(3,4,5-TRIHYDROXY-
6-HYDROXYMETHYL-TETRAHYDRO-PYRAN-
2-YLOXY)-TETRAHYDRO-PYRAN-2-YLOXY]-
1-OCTADEC-9-ENOYLOXYMETHYL-ETHYL ESTER
L,M1M3X0.73
B2S(3alpha,7alpha)-3,7,15-trihydroxy-
12,13-epoxytrichothec-9-en-8-one
A3B2S0.74
AB03,7:6,10:9,14-TRIANHYDRO-2,5,11,12,13-
PENTADEOXY-4-O-(METHOXYMETHYL)-
L-ARABINO-L-ALLO-TETRADEC-12-ENONIC ACID
H,L2E270.7
SXNSalinixanthinA,B3DDL0.77
TSA8-HYDROXY-2-OXA-BICYCLO[3.3.1]NON-
6-ENE-3,5-DICARBOXYLIC ACID
A,B1ECM0.71
TSA8-HYDROXY-2-OXA-BICYCLO[3.3.1]NON-
6-ENE-3,5-DICARBOXYLIC ACID
A,B,C,D,E,F,
G,H,I,J,K,L
2CHT0.71
TSA8-HYDROXY-2-OXA-BICYCLO[3.3.1]NON-
6-ENE-3,5-DICARBOXYLIC ACID
X2GTV0.71
TSA8-HYDROXY-2-OXA-BICYCLO[3.3.1]NON-
6-ENE-3,5-DICARBOXYLIC ACID
H1FIG0.71
TSA8-HYDROXY-2-OXA-BICYCLO[3.3.1]NON-
6-ENE-3,5-DICARBOXYLIC ACID
A,B4CSM0.71
TSA8-HYDROXY-2-OXA-BICYCLO[3.3.1]NON-
6-ENE-3,5-DICARBOXYLIC ACID
A,B3CSM0.71
TSA8-HYDROXY-2-OXA-BICYCLO[3.3.1]NON-
6-ENE-3,5-DICARBOXYLIC ACID
B2FP20.71