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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02675044

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
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,D1Y0G0.7
NE23,3',4',5-TETRACHLOROBIPHENYL-4-
OL
A,B2GAB0.77
4NA1-CHLORO-6-(4-HYDROXYPHENYL)-2-
NAPHTHOL
A,B1YY40.73
BPYBIPHENYL-2,3-DIOLA1KMY0.7
BPYBIPHENYL-2,3-DIOLB1KW80.7
BPYBIPHENYL-2,3-DIOLA2EI30.7
BPYBIPHENYL-2,3-DIOLA1EIR0.7
BPYBIPHENYL-2,3-DIOLB1KW60.7
BPYBIPHENYL-2,3-DIOLB1KWC0.7
BPYBIPHENYL-2,3-DIOLB1KW90.7
ETC(R,R)-5,11-CIS-DIETHYL-5,6,11,12-
TETRAHYDROCHRYSENE-2,8-DIOL
A,B1L2I0.7
ETC(R,R)-5,11-CIS-DIETHYL-5,6,11,12-
TETRAHYDROCHRYSENE-2,8-DIOL
A,B1L2J0.7
HXS4-[(1R,2S)-1-ethyl-2-(4-hydroxyphenyl)butyl]phenolA,B3CV60.76
17M17-METHYL-17-ALPHA-DIHYDROEQUILENINA,B2B1Z0.71
NE12',3,3',4',5-PENTACHLOROBIPHENYL-
4-OL
A,B2G9K0.76
43M4-CHLORO-3-METHYLPHENOLA2P7A0.74
1564-[3-OXO-3-(5,5,8,8-TETRAMETHYL-
5,6,7,8-TETRAHYDRO-NAPHTHALEN-2-
YL)-PROPENYL]-BENZOIC ACID
A1FCZ0.7
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
TTB4-[(1E)-2-(5,5,8,8-TETRAMETHYL-
5,6,7,8-TETRAHYDRONAPHTHALEN-2-
YL)PROP-1-ENYL]BENZOIC ACID
A1XAP0.7
EPTHEPTANYL-P-PHENOLA,B1AHZ0.72
269(1R)-3-chloro-1-phenylpropan-1-
ol
A2RBS0.76
2NAnaphthalen-2-ylmethanolA,B,C3EE50.75
BP32'-CHLORO-BIPHENYL-2,3-DIOLA1LGT0.77
BP71,1'-BIPHENYL-3,4-DIOLA2EI00.7
SS11-PHENYLETHANOLH1UM50.73
1OH4-(1-methyl-1-phenylethyl)phenolA2ZAS0.79
TN15,6,7,8-TETRAHYDRONAPHTHALEN-1-
OL
A1YSG0.7
DESDIETHYLSTILBESTROLA,B,C,D1S9P0.74
DESDIETHYLSTILBESTROLA,B3ERD0.74
DESDIETHYLSTILBESTROLA,B1TT60.74
DESDIETHYLSTILBESTROLA,B,C,D1TZ80.74
IPB5-METHYL-2-(1-METHYLETHYL)PHENOLA,B1E060.72
EYK2-tert-butylbenzene-1,4-diolD,F3EYM0.72
EYK2-tert-butylbenzene-1,4-diolB3EYK0.72
AFI2-[4-(4-CHLOROPHENYL)CYCLOHEXYLIDENE]-
3,4-DIHYDROXY-1(2H)-NAPHTHALENONE
A,B1UUM0.74
LYL2-ALLYL-6-METHYL-PHENOLA1OV70.71
BP62',6'-DICHLORO-BIPHENYL-2,6-DIOLA1LKD0.76
BPZ4,4'-cyclohexane-1,1-diyldiphenolA2ZKC0.76
LJ12,6-dimethyl-4-[(E)-2-phenylethenyl]phenolA,B3CN00.74
HSI(3R)-3-{4-[(4-CHLOROPHENYL)ETHYNYL]BENZOYL}NONANOIC ACIDA2Z2D0.7
12M(2-ETHYLPHENYL)METHANOLA,B2F620.73
2OH4,4'-PROPANE-2,2-DIYLDIPHENOLA2E2R0.78
2OH4,4'-PROPANE-2,2-DIYLDIPHENOLA2P7G0.78
BHQ2,5-DITERT-BUTYLBENZENE-1,4-DIOLA,B2AGV0.72
SS2(1R)-1-PHENYLETHANOLA1ZK00.73
SS2(1R)-1-PHENYLETHANOLA1ZJZ0.73
SS2(1R)-1-PHENYLETHANOLA1ZJY0.73
PCQ3,5,3',5'-TETRACHLORO-BIPHENYL-
4,4'-DIOL
A,B1G3M0.76
PCQ3,5,3',5'-TETRACHLORO-BIPHENYL-
4,4'-DIOL
A,B2G5U0.76
PFL2,6-BIS(1-METHYLETHYL)PHENOLA,B1E7A0.72