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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03916417

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
9741-[2-[5-[AMINO(IMINO)METHYL]-2-
HYDROXYPHENOXY]-6-[3-(4,5-DIHYDRO-
1-METHYL-1H-IMIDAZOL-2-YL)PHENOXY] PYRIDIN-
4-YL]PIPERIDINE-3-CARBOXYLIC ACID
A1QB10.7
090N-(2,3-DIHYDRO-7,8-DIMETHOXYIMIDAZO[1,2-
C] QUINAZOLIN-5-YL)NICOTINAMIDE
A2CHX0.71
4CO4-HYDROXYPHENACYL COENZYME AA,B1Q4T0.77
4CO4-HYDROXYPHENACYL COENZYME AA1LO70.77
6FA6-HYDROXY-FLAVIN-ADENINE DINUCLEOTIDEA,B1NAA0.73
6FA6-HYDROXY-FLAVIN-ADENINE DINUCLEOTIDEA,B1KDG0.73
2071-AMINO-6-CYCLOHEX-3-ENYLMETHYLOXYPURINEA1H0W0.7
00A5'-O-[(S)-{[(4-chlorophenyl)carbonyl]oxy}(hydroxy)phosphoryl]adenosineX3CW80.79
ABS(S)-(N-PHENYL-2-HYDROXY-ETHYL)-
2'-DEOXY-ADENOSINE-5'-MONOPHOSPHATE
A1K5F0.8
BCA4-HYDROXYBENZOYL COENZYME AA,B,C1NZY0.77
BCA4-HYDROXYBENZOYL COENZYME AA,B,C1JXZ0.77
BCA4-HYDROXYBENZOYL COENZYME AA1LO90.77
4CA4-HYDROXYBENZYL COENZYME AA1LO80.78
4CA4-HYDROXYBENZYL COENZYME AA1Q4U0.78
AGNA1GNP0.74
2A62-ANILINO-6-CYCLOHEXYLMETHOXYPURINEA,C1H1Q0.7
1PMmethyl (3S)-3-{2-[(1,3-benzodioxol-
5-ylmethyl)amino]-2-oxoethyl}-4-
[2-(1H-imidazol-1-yl)pyrimidin-
4-yl]piperazine-1-carboxylate
A1DD70.74
3122-(5-{5-[AMINO(IMINIO)METHYL]-1H-
BENZIMIDAZOL-2-YL}-2'-METHOXY-6-
OXIDO-1,1'-BIPHENYL-3-YL)SUCCINATE
A1O2Z0.71
ABR(R)-(N-PHENYL-2-HYDROXY-ETHYL)-
2'-DEOXY-ADENOSINE-5'-MONOPHOSPHATE
A1K5E0.8
228N-[2-(1,3-BENZODIOXOL-5-YL)ETHYL]-
1-[2-(1H-IMIDAZOL-1-YL)-6-METHYLPYRIMIDIN-
4-YL]-D-PROLINAMIDE
A2ORO0.74
ANZA2V0C0.78
ANZA,B,D,F2V0G0.78
3GO4-[[(2R,3S,4R,5R)-5-[6-amino-8-
(quinolin-6-ylmethylamino)purin-
9-yl]-3,4-dihydroxy-oxolan-2-yl]methoxymethyl]benzonitrile
A3FZM0.7
3FD4-[[(2R,3S,4R,5R)-5-[6-amino-8-
[(3,4-dichlorophenyl)methylamino]purin-
9-yl]-3,4-dihydroxy-oxolan-2-yl]methoxymethyl]benzonitrile
A3FZL0.71
A3D3-ACETYLPYRIDINE ADENINE DINUCLEOTIDEA,B,C,D1PZG0.71
A3D3-ACETYLPYRIDINE ADENINE DINUCLEOTIDEA1DRV0.71
A3D3-ACETYLPYRIDINE ADENINE DINUCLEOTIDEA,B2EWD0.71
A3D3-ACETYLPYRIDINE ADENINE DINUCLEOTIDEA,B,C,D1PZF0.71
1DG(4R)-ISONICOTINIC-ACETYL-NICOTINAMIDE-
ADENINE DINUCLEOTIDE
A2CIG0.71