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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02157609

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
2724-(6-HYDROXY-BENZO[D]ISOXAZOL-3-
YL)BENZENE-1,3-DIOL
A,B,C,D1U3Q0.76
PXBparecoxibA2ZMB0.79
IX15-(3-{3-[3-HYDROXY-2-(METHOXYCARBONYL)PHENOXY]PROPENYL}PHENYL)-
4-(HYDROXYMETHYL)ISOXAZOLE-3-CARBOXYLIC ACID
A1XBO0.71
SOYOXACILLIN-ACYLATED SERINEA2IWD0.71
0643-[(E)-2-(2-chloro-4-{[3-(2,6-dichlorophenyl)-
5-(1-methylethyl)isoxazol-4-yl]methoxy}phenyl)ethenyl]benzoic acid
A3DCT0.71
2345-{2-FLUORO-5-[3-(3-HYDROXY-2-METHOXYCARBONYL-
PHENOXY)-PROPENYL]-PHENYL}-ISOXAZOLE-
3-CARBOXYLIC ACID
A1Q1M0.72
105N-[5-METHYL-3-O-TOLYL-ISOXAZOLE-
4-CARBOXYLIC ACID AMIDE] BORONIC ACID
A1JWZ0.78
105N-[5-METHYL-3-O-TOLYL-ISOXAZOLE-
4-CARBOXYLIC ACID AMIDE] BORONIC ACID
A,B1FSY0.78
105N-[5-METHYL-3-O-TOLYL-ISOXAZOLE-
4-CARBOXYLIC ACID AMIDE] BORONIC ACID
A1NYY0.78
COX4-(5-METHYL-3-PHENYLISOXAZOL-4-
YL)BENZENESULFONAMIDE
A2AW10.77
AG74-{2-(4-FLUORO-BENZYL)-6-METHYL-
5-[(5-METHYL-ISOXAZOLE-3-CARBONYL)-
AMINO]-4-OXO-HEPTANOYLAMINO}-5-
(2-OXO-PYRROLIDIN-3-YL)-PENTANOIC ACID ETHYL ESTER
A1CQQ0.71
7973-(6-HYDROXY-NAPHTHALEN-2-YL)-BENZO[D]ISOOXAZOL-
6-OL
A,B1U3S0.71
6C36-CHLORO-3-(3-METHYLISOXAZOL-5-
YL)-4-PHENYLQUINOLIN-2(1H)-ONE
A2I0V0.73
BXZ4-bromo-6-(6-hydroxy-1,2-benzisoxazol-
3-yl)benzene-1,3-diol
A3BM90.71