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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02181503

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
PCQ3,5,3',5'-TETRACHLORO-BIPHENYL-
4,4'-DIOL
A,B1G3M0.74
PCQ3,5,3',5'-TETRACHLORO-BIPHENYL-
4,4'-DIOL
A,B2G5U0.74
2MP3,4-DIMETHYLPHENOLA1L5O0.72
ETY4-ethylphenolA,B,C,D2RA60.71
2NAnaphthalen-2-ylmethanolA,B,C3EE50.7
SS2(1R)-1-PHENYLETHANOLA1ZK00.76
SS2(1R)-1-PHENYLETHANOLA1ZJZ0.76
SS2(1R)-1-PHENYLETHANOLA1ZJY0.76
BP32'-CHLORO-BIPHENYL-2,3-DIOLA1LGT0.75
BP62',6'-DICHLORO-BIPHENYL-2,6-DIOLA1LKD0.73
EPTHEPTANYL-P-PHENOLA,B1AHZ0.72
APGATROLACTIC ACID (2-PHENYL-LACTIC ACID)A1MRA0.7
APGATROLACTIC ACID (2-PHENYL-LACTIC ACID)A1MNS0.7
APGATROLACTIC ACID (2-PHENYL-LACTIC ACID)A1DTN0.7
APGATROLACTIC ACID (2-PHENYL-LACTIC ACID)A1MDR0.7
2LP2-ALLYLPHENOLA1OV50.71
LYL2-ALLYL-6-METHYL-PHENOLA1OV70.73
NDH(1R, 2S)-CIS 1,2 DIHYDROXY-1,2-
DIHYDRONAPHTHALENE
A,B1O7P0.72
NE23,3',4',5-TETRACHLOROBIPHENYL-4-
OL
A,B2GAB0.73
PFL2,6-BIS(1-METHYLETHYL)PHENOLA,B1E7A0.73
3BZ3-chlorobenzoateX2QVZ0.71
3BZ3-chlorobenzoateX2QVX0.71
SS11-PHENYLETHANOLH1UM50.76
4NA1-CHLORO-6-(4-HYDROXYPHENYL)-2-
NAPHTHOL
A,B1YY40.71
NE12',3,3',4',5-PENTACHLOROBIPHENYL-
4-OL
A,B2G9K0.73
IPB5-METHYL-2-(1-METHYLETHYL)PHENOLA,B1E060.71
269(1R)-3-chloro-1-phenylpropan-1-
ol
A2RBS0.78
43M4-CHLORO-3-METHYLPHENOLA2P7A0.76
12M(2-ETHYLPHENYL)METHANOLA,B2F620.78
2CL(2,6-DICHLOROPHENYL)ACETIC ACIDA2IPW0.7
2CL(2,6-DICHLOROPHENYL)ACETIC ACIDA2IS70.7