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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00016041

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
SSPDITHIOBIS-(PROPANE)A,B455D0.78
XL3propane-1-thiolB3BTY0.82
XL3propane-1-thiolA,B3BUC0.82
D1TDECANE-1-THIOLA,B2QO10.81
D1TDECANE-1-THIOLA,B2QO00.81
D1TDECANE-1-THIOLA,B2QX10.81
SCCTHIOETHYL GROUPA,B3BKZ0.71
SCCTHIOETHYL GROUPA,B3BIE0.71
SCCTHIOETHYL GROUPB3BTZ0.71
SCCTHIOETHYL GROUPA1R4S0.71
SCCTHIOETHYL GROUPA,B3BTX0.71
SCCTHIOETHYL GROUPA1XVK0.71
SCCTHIOETHYL GROUPE,I1EPQ0.71
SCCTHIOETHYL GROUPA,B3BI30.71
SCCTHIOETHYL GROUPA,B3BU00.71
SCCTHIOETHYL GROUPA1XVN0.71
PDT1,3-PROPANEDITHIOLA,D,E1E080.72
PDT1,3-PROPANEDITHIOLA,E1GX70.72
PDT1,3-PROPANEDITHIOLL,M,S1HFE0.72