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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03019770

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
2TN2-(4-(2-HYDROXY-3-(ISOPROPYLAMINO)PROPOXY)PHENYL)ETHANAMIDEA2OTF0.78
2TN2-(4-(2-HYDROXY-3-(ISOPROPYLAMINO)PROPOXY)PHENYL)ETHANAMIDEA2NUV0.78
2TN2-(4-(2-HYDROXY-3-(ISOPROPYLAMINO)PROPOXY)PHENYL)ETHANAMIDEA2OUB0.78
5PP5-PENTYL-2-PHENOXYPHENOLA,B,C,D,E,F2B360.71
5RM(5R)-5-(4-methoxy-3-propoxyphenyl)-
5-methyl-1,3-oxazolidin-2-one
A,B1XM60.72
8PS5-OCTYL-2-PHENOXYPHENOLA,B,C,D,E,F2B370.71
AEG4-[(2R)-2-aminopropyl]phenolA3BUF0.8
AED4-(2-aminoethyl)-2-cyclohexylphenolA3BUH0.76
258(2-chloroethoxy)benzeneX2RAY0.73
2682-phenoxyethanolA2RBR0.72
2PMN-[2-(BENZHYDRYLOXY)ETHYL]-N,N-
DIMETHYLAMINE
A,B2AOT0.7
2NIN-{2-[(4'-CYANO-1,1'-BIPHENYL-4-
YL)OXY]ETHYL}-N'-HYDROXY-N-METHYLUREA
A1ZP50.72
AEF4-(2-aminoethyl)phenolA3BRA0.81
296(3R)-3-amino-2,2-difluoro-3-(4-
methoxyphenyl)propanoic acid
A,B2RJS0.74
505(2R)-1-(2,6-dimethylphenoxy)propan-
2-amine
A2VIN0.87
4SR(4S)-4-[3-(CYCLOPENTYLOXY)-4-METHOXYPHENYL]PYRROLIDIN-
2-ONE
A,B1XN00.73
4BGN-[4-(benzyloxy)phenyl]glycinamideA3CHO0.71
AEH4-(2-aminoethyl)-2-ethylphenolA3BUG0.79
4BS4-amino-N-[4-(benzyloxy)phenyl]butanamideA3CHR0.71
3MB3-METHOXYBENZAMIDEA3PAX0.73
4HL4-(HYDRAZINOMETHYL)PHENOLA,B2E2U0.71
4BR2-(4-METHYLPHENOXY)ETHYLPHOSPHINATEA1PE70.8