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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00022960

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
LYL2-ALLYL-6-METHYL-PHENOLA1OV70.7
43M4-CHLORO-3-METHYLPHENOLA2P7A0.75
OBZO-benzylhydroxylamineA,B3DTH0.71
OBZO-benzylhydroxylamineA,B3DTG0.71
3BZ3-chlorobenzoateX2QVZ0.72
3BZ3-chlorobenzoateX2QVX0.72
NE12',3,3',4',5-PENTACHLOROBIPHENYL-
4-OL
A,B2G9K0.71
2NAnaphthalen-2-ylmethanolA,B,C3EE50.72
SS2(1R)-1-PHENYLETHANOLA1ZK00.76
SS2(1R)-1-PHENYLETHANOLA1ZJZ0.76
SS2(1R)-1-PHENYLETHANOLA1ZJY0.76
DFB2,3-DIFLUOROBENZYL ALCOHOLA,B1QV70.82
DFB2,3-DIFLUOROBENZYL ALCOHOLA,B,C,D1MG00.82
FCRALPHA,ALPHA,ALPHA-TRIFLUORO-P-CRESOLA,B1E0Y0.71
FCRALPHA,ALPHA,ALPHA-TRIFLUORO-P-CRESOLA,B1E8G0.71
269(1R)-3-chloro-1-phenylpropan-1-
ol
A2RBS0.81
NDH(1R, 2S)-CIS 1,2 DIHYDROXY-1,2-
DIHYDRONAPHTHALENE
A,B1O7P0.7
12M(2-ETHYLPHENYL)METHANOLA,B2F620.76
BRBPARA-BROMOBENZYL ALCOHOLA,B1HLD0.71
1744-CHLORO-BENZOIC ACIDX3DLP0.73
1744-CHLORO-BENZOIC ACIDX1T5D0.73
2CL(2,6-DICHLOROPHENYL)ACETIC ACIDA2IPW0.71
2CL(2,6-DICHLOROPHENYL)ACETIC ACIDA2IS70.71
IOB3-IODO-BENZYL ALCOHOLA,B1QK00.77
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
MXN(2R)-hydroxy(phenyl)ethanenitrileA,B3GDN0.73
24B(2,4-DIFLUOROPHENYL)METHANOLA,B1QV60.82
SS11-PHENYLETHANOLH1UM50.76
4FA4-FLUOROPHENETHYL ALCOHOLA1OWZ0.75
34Z3,4-dichlorobenzoateX2QVY0.7
34Z3,4-dichlorobenzoateX2QW00.7
BP32'-CHLORO-BIPHENYL-2,3-DIOLA1LGT0.71
PFB2,3,4,5,6-PENTAFLUOROBENZYL ALCOHOLA,B1MGO0.73
PFB2,3,4,5,6-PENTAFLUOROBENZYL ALCOHOLA,B1HLD0.73
341(3,5-difluorophenyl)methanolC3EON0.81
MNN(S)-MANDELIC ACID NITRILEA1YB60.73