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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00004954

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
FBS4-FLOUROBENZENESULFONAMIDEA1IF40.76
PMBPARA-MERCURY-BENZENESULFONIC ACIDB1BH90.8
PMBPARA-MERCURY-BENZENESULFONIC ACIDH1HDK0.8
PMBPARA-MERCURY-BENZENESULFONIC ACIDA1HJ10.8
PMBPARA-MERCURY-BENZENESULFONIC ACIDA,B,C,D1YP20.8
PMBPARA-MERCURY-BENZENESULFONIC ACIDA1XZC0.8
FBT2,6-DIFLUOROBENZENESULFONAMIDEA1IF50.74
TOSP-SULFINOTOLUENEH1ETT0.71
TOSP-SULFINOTOLUENEI4PAD0.71
TOSP-SULFINOTOLUENEA1EST0.71
TOSP-SULFINOTOLUENEC,G2CHA0.71
TOSP-SULFINOTOLUENEE1PPH0.71
FBU3,5-DIFLUOROBENZENESULFONAMIDEA1IF60.74
PVS(ethenylsulfonyl)benzeneA3BLU0.91
NAS2-NAPHTHALENESULFONIC ACIDI1QUR0.71
NAS2-NAPHTHALENESULFONIC ACIDE,I1PPC0.71
NAS2-NAPHTHALENESULFONIC ACIDH1ETS0.71
BPSA,B2DE40.74
TSUPARA-TOLUENE SULFONATEA,B1WUW0.72
TSUPARA-TOLUENE SULFONATEA1B0D0.72
NBBN-BUTYL-BENZENESULFONAMIDEA,B3D730.73
NBBN-BUTYL-BENZENESULFONAMIDEA3D770.73
NBBN-BUTYL-BENZENESULFONAMIDEA,B3D780.73
NBBN-BUTYL-BENZENESULFONAMIDEA,B3CZ10.73
NBBN-BUTYL-BENZENESULFONAMIDEA3D750.73
NBBN-BUTYL-BENZENESULFONAMIDEA3D760.73
NBBN-BUTYL-BENZENESULFONAMIDEA3BJH0.73
NBBN-BUTYL-BENZENESULFONAMIDEA,B3D740.73
BT6benzenethiolA,B,C,D3HSR0.74
SMLPHENYL METHYL SULFONEA,I1D6W0.9
SMLPHENYL METHYL SULFONEA,I1D9I0.9
BNSHYDROSULFONYLBENZENE11YYY0.85
BNSHYDROSULFONYLBENZENEA1MEM0.85
BNSHYDROSULFONYLBENZENEA,D,E1FH00.85
BNSHYDROSULFONYLBENZENEA,B,C,D1PQ90.85