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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00011382

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
PVS(ethenylsulfonyl)benzeneA3BLU0.73
TCZ1,3,5-TRICHLORO-BENZENEA,B,C,D1J510.72
FBT2,6-DIFLUOROBENZENESULFONAMIDEA1IF50.72
FBU3,5-DIFLUOROBENZENESULFONAMIDEA1IF60.72
BNSHYDROSULFONYLBENZENE11YYY0.82
BNSHYDROSULFONYLBENZENEA1MEM0.82
BNSHYDROSULFONYLBENZENEA,D,E1FH00.82
BNSHYDROSULFONYLBENZENEA,B,C,D1PQ90.82
TOSP-SULFINOTOLUENEH1ETT0.71
TOSP-SULFINOTOLUENEI4PAD0.71
TOSP-SULFINOTOLUENEA1EST0.71
TOSP-SULFINOTOLUENEC,G2CHA0.71
TOSP-SULFINOTOLUENEE1PPH0.71
SMLPHENYL METHYL SULFONEA,I1D6W0.74
SMLPHENYL METHYL SULFONEA,I1D9I0.74
PMBPARA-MERCURY-BENZENESULFONIC ACIDB1BH90.83
PMBPARA-MERCURY-BENZENESULFONIC ACIDH1HDK0.83
PMBPARA-MERCURY-BENZENESULFONIC ACIDA1HJ10.83
PMBPARA-MERCURY-BENZENESULFONIC ACIDA,B,C,D1YP20.83
PMBPARA-MERCURY-BENZENESULFONIC ACIDA1XZC0.83
TSUPARA-TOLUENE SULFONATEA,B1WUW0.72
TSUPARA-TOLUENE SULFONATEA1B0D0.72
BT6benzenethiolA,B,C,D3HSR0.72
YAN1,2-DICHLOROBENZENEX2OTY0.73
I7A4,5-DICHLOROBENZENE-1,3-DISULFONAMIDEA2POU0.79
FBS4-FLOUROBENZENESULFONAMIDEA1IF40.74