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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs01101098

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
1784-(4-HYDROXY-3-ISOPROPYLPHENYLTHIO)-
2-ISOPROPYLPHENOL
A,B1TVE0.75
PSYphenyl ethenesulfonateA3BM80.73
PSYphenyl ethenesulfonateA3BLT0.73
FPN4-FLUOROPHENOLA,B1XVD0.71
HSP4-(2-HYDROXYPHENYLSULFINYL)-BUTYLPHOSPHONIC ACIDA,B1CW20.83
S24S-(2,4-dihydroxyphenyl) hydrogen thiocarbonateA2OSF0.78
HE14-(2-HYDROXYPHENYLTHIO)-1-BUTENYLPHOSPHONIC ACIDA,B1C8V0.85
HE14-(2-HYDROXYPHENYLTHIO)-1-BUTENYLPHOSPHONIC ACIDA,B1C290.85
W294-(3-ethylthiophen-2-yl)benzene-
1,2-diol
A3D270.74
IOL4-IODOPHENOLA,B1EWA0.71
IPHPHENOLA,B2OLD0.73
IPHPHENOLA,B,C,D2PZV0.73
IPHPHENOLA1LI20.73
IPHPHENOLA2J9N0.73
IPHPHENOLA,B,C,D2OMB0.73
IPHPHENOLA1JHX0.73
IPHPHENOLA,B,C,D2VE70.73
IPHPHENOLB,D,E,G,H,J,L1AI00.73
IPHPHENOLA,B,C,D1FOH0.73
IPHPHENOLA1V030.73
IPHPHENOLA,C,E,G,I,K5AIY0.73
IPHPHENOLB,D,F,H,J,L1AIY0.73
IPHPHENOLA,B1XU50.73
IPHPHENOLA,B,C,D,E,G,
I,K
1W8P0.73
IPHPHENOLA,C,E,G,I,K4AIY0.73
IPHPHENOLA,B,C,D,E,F,
G,H
1XDA0.73
IPHPHENOLA2AS30.73
IPHPHENOLA,B,C,D1ZEG0.73
IPHPHENOLA,B,C,D1PN00.73
IPHPHENOLA,B,C,D1XW70.73
IPHPHENOLA,C,E,G,I,K,M1QIY0.73
IPHPHENOLA,B,C,D1Q4V0.73
IPHPHENOLB1AI70.73
IPHPHENOLA1FJW0.73
IPHPHENOLB,C,D1RWE0.73
IPHPHENOLA,B,C,D,E,G,
H,I,K
1ZNJ0.73
IPHPHENOLB,C,D3GKY0.73
IPHPHENOLA1JHY0.73
IPHPHENOLA,C,E,G,I,K3AIY0.73
IPHPHENOLA,B2OMN0.73
IPHPHENOLA,C,E,G,I,K2AIY0.73
IPHPHENOLA,B,D1MPJ0.73
IPHPHENOLA,B,C,D,F,G,
H,J
1WAV0.73
IPHPHENOLB,C,D1LPH0.73
HF14-(2-HYDROXY-4-FLUOROPHENYLTHIO)-
BUTYLPHOSPHONIC ACID
A,B1C9D0.83
HTS2-MERCAPTOPHENOLA2OSM0.81
FP22-fluorophenolA3CPO0.71
TH04-MERCAPTOBENZENE-1,3-DIOLA2OSF0.76
CAQCATECHOLB2BUY0.7
CAQCATECHOLA1KND0.7
CAQCATECHOLB2BUQ0.7
CAQCATECHOLA,B1DLT0.7
CAQCATECHOLA1XEP0.7
CAQCATECHOLA2PUM0.7
ZTWRALOXIFENE COREA,B1GWQ0.71
4403-{[4-(but-2-yn-1-yloxy)phenyl]sulfonyl}propane-
1-thiol
A3B920.7