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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02676601

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
FP22-fluorophenolA3CPO0.72
PYGBENZENE-1,2,3-TRIOLA,B,C,D,E,F,
G,H,I,J,K,L
1TI40.76
PYGBENZENE-1,2,3-TRIOLM,N,O,P,Q,R,
S,T,U,V,W,X
1VLE0.76
TC72,4,5-trichlorophenolA2VCE0.87
TTO(3,4-DIHYDROXY-PHENYL)-TRIPHENYL-
ARSONIUM
A1HYZ0.71
BP32'-CHLORO-BIPHENYL-2,3-DIOLA1LGT0.75
CFA(2,4-DICHLOROPHENOXY)ACETIC ACIDB,E2P1N0.72
PCQ3,5,3',5'-TETRACHLORO-BIPHENYL-
4,4'-DIOL
A,B1G3M0.75
PCQ3,5,3',5'-TETRACHLORO-BIPHENYL-
4,4'-DIOL
A,B2G5U0.75
CAQCATECHOLB2BUY0.81
CAQCATECHOLA1KND0.81
CAQCATECHOLB2BUQ0.81
CAQCATECHOLA,B1DLT0.81
CAQCATECHOLA1XEP0.81
CAQCATECHOLA2PUM0.81
PCIPENTACHLOROPHENOLA,B2GWH0.78
PCIPENTACHLOROPHENOLA,B,C1Y5N0.78
PCIPENTACHLOROPHENOLA,B,C1Y4Z0.78
PCIPENTACHLOROPHENOLA,B,C,E,F,G2VPY0.78
IPHPHENOLA,B2OLD0.74
IPHPHENOLA,B,C,D2PZV0.74
IPHPHENOLA1LI20.74
IPHPHENOLA2J9N0.74
IPHPHENOLA,B,C,D2OMB0.74
IPHPHENOLA1JHX0.74
IPHPHENOLA,B,C,D2VE70.74
IPHPHENOLB,D,E,G,H,J,L1AI00.74
IPHPHENOLA,B,C,D1FOH0.74
IPHPHENOLA1V030.74
IPHPHENOLA,C,E,G,I,K5AIY0.74
IPHPHENOLB,D,F,H,J,L1AIY0.74
IPHPHENOLA,B1XU50.74
IPHPHENOLA,B,C,D,E,G,
I,K
1W8P0.74
IPHPHENOLA,C,E,G,I,K4AIY0.74
IPHPHENOLA,B,C,D,E,F,
G,H
1XDA0.74
IPHPHENOLA2AS30.74
IPHPHENOLA,B,C,D1ZEG0.74
IPHPHENOLA,B,C,D1PN00.74
IPHPHENOLA,B,C,D1XW70.74
IPHPHENOLA,C,E,G,I,K,M1QIY0.74
IPHPHENOLA,B,C,D1Q4V0.74
IPHPHENOLB1AI70.74
IPHPHENOLA1FJW0.74
IPHPHENOLB,C,D1RWE0.74
IPHPHENOLA,B,C,D,E,G,
H,I,K
1ZNJ0.74
IPHPHENOLB,C,D3GKY0.74
IPHPHENOLA1JHY0.74
IPHPHENOLA,C,E,G,I,K3AIY0.74
IPHPHENOLA,B2OMN0.74
IPHPHENOLA,C,E,G,I,K2AIY0.74
IPHPHENOLA,B,D1MPJ0.74
IPHPHENOLA,B,C,D,F,G,
H,J
1WAV0.74
IPHPHENOLB,C,D1LPH0.74
TCLTRICLOSANA,B,C,D2PD30.82
TCLTRICLOSANA,B1P450.82
TCLTRICLOSANA,B,C,D,E,F2B350.82
TCLTRICLOSANA,B1D8A0.82
TCLTRICLOSANA,B1C140.82
TCLTRICLOSANA,B,C,D2QIO0.82
TCLTRICLOSANA,B1NHG0.82
TCLTRICLOSANA1D7O0.82
TCLTRICLOSANA,B,C,D2O2Y0.82
TCLTRICLOSANA,B1UH50.82
TCLTRICLOSANA,B2O2S0.82
TCLTRICLOSANA,B,C,D1QG60.82
TCLTRICLOSANA,B,C,D,E,F,
G,H
1QSG0.82
RCORESORCINOLA,B,C,E,F,G,
H,I,J,K
2OLY0.71
RCORESORCINOL1,3,A,B,C,D,
E,G,H,I,K,Q,
R,S,T,U,X,Y
2OM10.71
RCORESORCINOLA,B,C,E,G,H,
I,K
2OLZ0.71
RCORESORCINOLA,B,C,D,E,F2OMH0.71
RCORESORCINOLA,B,C,E,G,H,
I,J,K
2OMI0.71
RCORESORCINOLA,B,C,D,E,G,
I,J,K
1EVR0.71
RCORESORCINOLA,C,E,G,I,K,M1QIZ0.71
RCORESORCINOL1,3,A,B,C,D,
E,G,H,I,K,Q,
R,S,U,X,Y
2OM00.71
2CH2-CHLOROPHENOLA1WBO0.88
MCT4-METHYLCATECHOLA1L4G0.72
MCT4-METHYLCATECHOLA2EHZ0.72
MCT4-METHYLCATECHOLA,B1DMH0.72
BP62',6'-DICHLORO-BIPHENYL-2,6-DIOLA1LKD0.76
NE12',3,3',4',5-PENTACHLOROBIPHENYL-
4-OL
A,B2G9K0.7
FPN4-FLUOROPHENOLA,B1XVD0.72
3CH3-CHLOROPHENOLA1LI30.86
NE23,3',4',5-TETRACHLOROBIPHENYL-4-
OL
A,B2GAB0.71
3C4(3-CHLORO-4-HYDROXYPHENYL)ACETIC ACIDA,B,C,D3E5U0.71
3C4(3-CHLORO-4-HYDROXYPHENYL)ACETIC ACIDA,B3E6B0.71
3C4(3-CHLORO-4-HYDROXYPHENYL)ACETIC ACIDA,B,C,D3E5X0.71
3C4(3-CHLORO-4-HYDROXYPHENYL)ACETIC ACIDA,B2H6B0.71
3C4(3-CHLORO-4-HYDROXYPHENYL)ACETIC ACIDC3E6C0.71
FFP2,6-DIFLUOROPHENOLA2INX0.7
DCNDICLOSANA,B,C,D2PD40.79
JPL5-(cyclohexa-1,5-dien-1-ylmethyl)-
2-(2,4-dichlorophenoxy)phenol
A3FNG0.7
43M4-CHLORO-3-METHYLPHENOLA2P7A0.76
IOL4-IODOPHENOLA,B1EWA0.72
MBD3-METHYLCATECHOLA1KNF0.71
3FA3-FLUOROBENZENE-1,2-DIOLA2AS40.78
BTTBENZENE-1,2,4,5-TETROLA,B,C,D,E,F,
G,H,I,J,K,L
1TI60.73
BTTBENZENE-1,2,4,5-TETROLM,N,O,P,Q,R,
S,T,U,V,W,X
1VLF0.73