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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs01771908

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
TOM4-(2-METHOXYPHENYL)-2-OXOBUT-3-
ENOIC ACID
A2IMF0.7
BZFBENZOFURANA182L0.81
DFL2-(4-HYDROXY-PHENYL)-CHROMAN-4-
ONE
A,B1JEP0.71
VII2,5-DIPHENYLFURAN-3,4-DICARBOXYLIC ACIDA,B2GFK0.7
258(2-chloroethoxy)benzeneX2RAY0.72
FOA2-FUROIC ACIDA,B2GF30.77
FOA2-FUROIC ACIDA,B,D2GAG0.77
FOA2-FUROIC ACIDA,B,C,D2GAH0.77
ANN4-METHOXYBENZOIC ACIDA2B960.72
ANN4-METHOXYBENZOIC ACIDA2QUE0.72
ANN4-METHOXYBENZOIC ACIDA1SV30.72
ANN4-METHOXYBENZOIC ACIDA1O2E0.72
ANN4-METHOXYBENZOIC ACIDA,B,C,D3CBI0.72
2682-phenoxyethanolA2RBR0.73
AI73-(heptyloxy)benzoic acidA,B2O3Z0.76
BZMBENZOIC ACID PHENYLMETHYLESTERA,B1DZM0.7
COUCOUMARINA3CRB0.71
COUCOUMARINA2PMJ0.71
COUCOUMARINA2H900.71
COUCOUMARINA,B,C,D1Z100.71
COUCOUMARINA2PWB0.71
FU2FURFURALA,B,C,D1QXD0.84
FUX5-HYDROXYMETHYL-FURFURALA,B,C,D1QXE0.77
AIN2-(ACETYLOXY)BENZOIC ACIDA3GCL0.73
AIN2-(ACETYLOXY)BENZOIC ACIDA2QQT0.73
AIN2-(ACETYLOXY)BENZOIC ACIDA1TGM0.73
AIN2-(ACETYLOXY)BENZOIC ACIDA2G5J0.73
AIN2-(ACETYLOXY)BENZOIC ACIDA1OXR0.73
AIN2-(ACETYLOXY)BENZOIC ACIDA3HWY0.73
3MB3-METHOXYBENZAMIDEA3PAX0.7
FLN2-PHENYL-4H-CHROMEN-4-ONEA2G0L0.76