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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00023646

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
PMBPARA-MERCURY-BENZENESULFONIC ACIDB1BH90.81
PMBPARA-MERCURY-BENZENESULFONIC ACIDH1HDK0.81
PMBPARA-MERCURY-BENZENESULFONIC ACIDA1HJ10.81
PMBPARA-MERCURY-BENZENESULFONIC ACIDA,B,C,D1YP20.81
PMBPARA-MERCURY-BENZENESULFONIC ACIDA1XZC0.81
TSUPARA-TOLUENE SULFONATEA,B1WUW0.71
TSUPARA-TOLUENE SULFONATEA1B0D0.71
BNSHYDROSULFONYLBENZENE11YYY0.81
BNSHYDROSULFONYLBENZENEA1MEM0.81
BNSHYDROSULFONYLBENZENEA,D,E1FH00.81
BNSHYDROSULFONYLBENZENEA,B,C,D1PQ90.81
SMLPHENYL METHYL SULFONEA,I1D6W0.73
SMLPHENYL METHYL SULFONEA,I1D9I0.73
PVS(ethenylsulfonyl)benzeneA3BLU0.72
FBU3,5-DIFLUOROBENZENESULFONAMIDEA1IF60.71
FBT2,6-DIFLUOROBENZENESULFONAMIDEA1IF50.71
FBS4-FLOUROBENZENESULFONAMIDEA1IF40.73
TOSP-SULFINOTOLUENEH1ETT0.72
TOSP-SULFINOTOLUENEI4PAD0.72
TOSP-SULFINOTOLUENEA1EST0.72
TOSP-SULFINOTOLUENEC,G2CHA0.72
TOSP-SULFINOTOLUENEE1PPH0.72
BT6benzenethiolA,B,C,D3HSR0.73