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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02099189

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
4FA4-FLUOROPHENETHYL ALCOHOLA1OWZ0.71
1784-(4-HYDROXY-3-ISOPROPYLPHENYLTHIO)-
2-ISOPROPYLPHENOL
A,B1TVE0.73
2NAnaphthalen-2-ylmethanolA,B,C3EE50.72
SS2(1R)-1-PHENYLETHANOLA1ZK00.76
SS2(1R)-1-PHENYLETHANOLA1ZJZ0.76
SS2(1R)-1-PHENYLETHANOLA1ZJY0.76
MNN(S)-MANDELIC ACID NITRILEA1YB60.71
NDH(1R, 2S)-CIS 1,2 DIHYDROXY-1,2-
DIHYDRONAPHTHALENE
A,B1O7P0.7
BZBBENZO[B]THIOPHENE-2-BORONIC ACIDA,B3FKV0.73
BZBBENZO[B]THIOPHENE-2-BORONIC ACIDA,B1C3B0.73
12M(2-ETHYLPHENYL)METHANOLA,B2F620.76
24B(2,4-DIFLUOROPHENYL)METHANOLA,B1QV60.72
MXN(2R)-hydroxy(phenyl)ethanenitrileA,B3GDN0.71
W294-(3-ethylthiophen-2-yl)benzene-
1,2-diol
A3D270.79
PEL2-PHENYL-ETHANOLA,B1I0D0.73
PEL2-PHENYL-ETHANOLD,H2I0T0.73
PEL2-PHENYL-ETHANOLA,B1HZY0.73
PEL2-PHENYL-ETHANOLA,B1I0B0.73
PEL2-PHENYL-ETHANOLA1EYW0.73
PEL2-PHENYL-ETHANOLA,B1JGM0.73
SS11-PHENYLETHANOLH1UM50.76
ZTWRALOXIFENE COREA,B1GWQ0.79
ISFA,B1PGE0.71
IOB3-IODO-BENZYL ALCOHOLA,B1QK00.73
DFB2,3-DIFLUOROBENZYL ALCOHOLA,B1QV70.72
DFB2,3-DIFLUOROBENZYL ALCOHOLA,B,C,D1MG00.72
269(1R)-3-chloro-1-phenylpropan-1-
ol
A2RBS0.72
341(3,5-difluorophenyl)methanolC3EON0.71