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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02864249

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
NE23,3',4',5-TETRACHLOROBIPHENYL-4-
OL
A,B2GAB0.77
43M4-CHLORO-3-METHYLPHENOLA2P7A0.75
BP62',6'-DICHLORO-BIPHENYL-2,6-DIOLA1LKD0.78
BPZ4,4'-cyclohexane-1,1-diyldiphenolA2ZKC0.72
EPTHEPTANYL-P-PHENOLA,B1AHZ0.73
2NAnaphthalen-2-ylmethanolA,B,C3EE50.72
LYL2-ALLYL-6-METHYL-PHENOLA1OV70.72
1744-CHLORO-BENZOIC ACIDX3DLP0.7
1744-CHLORO-BENZOIC ACIDX1T5D0.7
THK4-(4-CHLORO-PHENYL)-1-{3-[2-(4-
FLUORO-PHENYL)-[1,3]DITHIOLAN-2-
YL]-PROPYL}-PIPERIDIN-4-OL
B1AID0.71
THK4-(4-CHLORO-PHENYL)-1-{3-[2-(4-
FLUORO-PHENYL)-[1,3]DITHIOLAN-2-
YL]-PROPYL}-PIPERIDIN-4-OL
A,B2AID0.71
PCQ3,5,3',5'-TETRACHLORO-BIPHENYL-
4,4'-DIOL
A,B1G3M0.77
PCQ3,5,3',5'-TETRACHLORO-BIPHENYL-
4,4'-DIOL
A,B2G5U0.77
SS11-PHENYLETHANOLH1UM50.74
NDH(1R, 2S)-CIS 1,2 DIHYDROXY-1,2-
DIHYDRONAPHTHALENE
A,B1O7P0.7
DESDIETHYLSTILBESTROLA,B,C,D1S9P0.75
DESDIETHYLSTILBESTROLA,B3ERD0.75
DESDIETHYLSTILBESTROLA,B1TT60.75
DESDIETHYLSTILBESTROLA,B,C,D1TZ80.75
BP32'-CHLORO-BIPHENYL-2,3-DIOLA1LGT0.78
4NA1-CHLORO-6-(4-HYDROXYPHENYL)-2-
NAPHTHOL
A,B1YY40.72
2CL(2,6-DICHLOROPHENYL)ACETIC ACIDA2IPW0.71
2CL(2,6-DICHLOROPHENYL)ACETIC ACIDA2IS70.71
8PP2-[(2E,6E,10E,14E,18E,22E,26E)-
3,7,11,15,19,23,27,31-OCTAMETHYLDOTRIACONTA-
2,6,10,14,18,22,26,30-OCTAENYL]PHENOL
A,B,C,D1Y0G0.71
AFI2-[4-(4-CHLOROPHENYL)CYCLOHEXYLIDENE]-
3,4-DIHYDROXY-1(2H)-NAPHTHALENONE
A,B1UUM0.74
PFL2,6-BIS(1-METHYLETHYL)PHENOLA,B1E7A0.75
ETC(R,R)-5,11-CIS-DIETHYL-5,6,11,12-
TETRAHYDROCHRYSENE-2,8-DIOL
A,B1L2I0.71
ETC(R,R)-5,11-CIS-DIETHYL-5,6,11,12-
TETRAHYDROCHRYSENE-2,8-DIOL
A,B1L2J0.71
12M(2-ETHYLPHENYL)METHANOLA,B2F620.74
NE12',3,3',4',5-PENTACHLOROBIPHENYL-
4-OL
A,B2G9K0.78
LJ12,6-dimethyl-4-[(E)-2-phenylethenyl]phenolA,B3CN00.75
HXS4-[(1R,2S)-1-ethyl-2-(4-hydroxyphenyl)butyl]phenolA,B3CV60.77
2OH4,4'-PROPANE-2,2-DIYLDIPHENOLA2E2R0.74
2OH4,4'-PROPANE-2,2-DIYLDIPHENOLA2P7G0.74
1OH4-(1-methyl-1-phenylethyl)phenolA2ZAS0.74
IPB5-METHYL-2-(1-METHYLETHYL)PHENOLA,B1E060.71
SS2(1R)-1-PHENYLETHANOLA1ZK00.74
SS2(1R)-1-PHENYLETHANOLA1ZJZ0.74
SS2(1R)-1-PHENYLETHANOLA1ZJY0.74
269(1R)-3-chloro-1-phenylpropan-1-
ol
A2RBS0.77