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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03359852

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
AD33-DEAZA-ADENOSINEA,B1KIE0.71
AD33-DEAZA-ADENOSINEA,B,C,D2ZIZ0.71
AD33-DEAZA-ADENOSINEA,B1R4F0.71
AD33-DEAZA-ADENOSINEA,B1HP00.71
3BK(2R,3R,4S,5R)-2-[6-amino-8-[(3,4-
dichlorophenyl)methylamino]purin-
9-yl]-5-(hydroxymethyl)oxolane-
3,4-diol
A3FZK0.74
4CO4-HYDROXYPHENACYL COENZYME AA,B1Q4T0.7
4CO4-HYDROXYPHENACYL COENZYME AA1LO70.7
AGNA1GNP0.78
ABR(R)-(N-PHENYL-2-HYDROXY-ETHYL)-
2'-DEOXY-ADENOSINE-5'-MONOPHOSPHATE
A1K5E0.72
BPG9-(4-HYDROXYBUTYL)-N2-PHENYLGUANINEA,B1QHI0.74
CNACARBA-NICOTINAMIDE-ADENINE-DINUCLEOTIDEA,B1SZC0.75
CNACARBA-NICOTINAMIDE-ADENINE-DINUCLEOTIDEA1A260.75
CNACARBA-NICOTINAMIDE-ADENINE-DINUCLEOTIDEA,B2OD20.75
1DG(4R)-ISONICOTINIC-ACETYL-NICOTINAMIDE-
ADENINE DINUCLEOTIDE
A2CIG0.75
5HI(3R,5R)-7-[2-(4-fluorophenyl)-4-
{[(1S)-2-hydroxy-1-phenylethyl]carbamoyl}-
5-(1-methylethyl)-1H-imidazol-1-
yl]-3,5-dihydroxyheptanoic acid
A,B,C,D3CCZ0.75
6HI(3R,5R)-7-{2-[(4-fluorobenzyl)carbamoyl]-
4-(4-fluorophenyl)-1-(1-methylethyl)-
1H-imidazol-5-yl}-3,5-dihydroxyheptanoic acid
B,C,D3CD00.71
8IDNICOTINAMIDE-8-IODO-ADENINE-DINUCLEOTIDEA,B,C,D2HCY0.76
CAGA1GNQ0.77
CAGA1PLJ0.77
CAGX2EVW0.77
CAGA1GNR0.77
CAGX2CL60.77
8FGN-(5'-PHOSPHO-2'-DEOXYGUANOSIN-
8-YL)-2-ACETYLAMINOFLUORENE
A,C,D1X9M0.77
CF22'-deoxy-5'-O-{[2-(7,8-dimethyl-
2,4-dioxo-3,4-dihydrobenzo[g]pteridin-
10(2H)-yl)ethyl]carbamoyl}guanosine
A2VKF0.76
01A4-Chlorophenacyl-coenzyme AA,B3CW90.73
ABS(S)-(N-PHENYL-2-HYDROXY-ETHYL)-
2'-DEOXY-ADENOSINE-5'-MONOPHOSPHATE
A1K5F0.72
4HI(3R,5R)-7-[4-(benzylcarbamoyl)-
2-(4-fluorophenyl)-5-(1-methylethyl)-
1H-imidazol-1-yl]-3,5-dihydroxyheptanoic acid
B,C,D3CCW0.76
00A5'-O-[(S)-{[(4-chlorophenyl)carbonyl]oxy}(hydroxy)phosphoryl]adenosineX3CW80.75
BCA4-HYDROXYBENZOYL COENZYME AA,B,C1NZY0.71
BCA4-HYDROXYBENZOYL COENZYME AA,B,C1JXZ0.71
BCA4-HYDROXYBENZOYL COENZYME AA1LO90.71
A3D3-ACETYLPYRIDINE ADENINE DINUCLEOTIDEA,B,C,D1PZG0.76
A3D3-ACETYLPYRIDINE ADENINE DINUCLEOTIDEA1DRV0.76
A3D3-ACETYLPYRIDINE ADENINE DINUCLEOTIDEA,B2EWD0.76
A3D3-ACETYLPYRIDINE ADENINE DINUCLEOTIDEA,B,C,D1PZF0.76