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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02309665

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
PVS(ethenylsulfonyl)benzeneA3BLU0.92
FBT2,6-DIFLUOROBENZENESULFONAMIDEA1IF50.75
FBU3,5-DIFLUOROBENZENESULFONAMIDEA1IF60.75
BBS4-TERT-BUTYLBENZENESULFONIC ACIDB1EOJ0.72
BBS4-TERT-BUTYLBENZENESULFONIC ACIDB1EOL0.72
NBBN-BUTYL-BENZENESULFONAMIDEA,B3D730.76
NBBN-BUTYL-BENZENESULFONAMIDEA3D770.76
NBBN-BUTYL-BENZENESULFONAMIDEA,B3D780.76
NBBN-BUTYL-BENZENESULFONAMIDEA,B3CZ10.76
NBBN-BUTYL-BENZENESULFONAMIDEA3D750.76
NBBN-BUTYL-BENZENESULFONAMIDEA3D760.76
NBBN-BUTYL-BENZENESULFONAMIDEA3BJH0.76
NBBN-BUTYL-BENZENESULFONAMIDEA,B3D740.76
TOSP-SULFINOTOLUENEH1ETT0.74
TOSP-SULFINOTOLUENEI4PAD0.74
TOSP-SULFINOTOLUENEA1EST0.74
TOSP-SULFINOTOLUENEC,G2CHA0.74
TOSP-SULFINOTOLUENEE1PPH0.74
FBS4-FLOUROBENZENESULFONAMIDEA1IF40.77
BNSHYDROSULFONYLBENZENE11YYY0.86
BNSHYDROSULFONYLBENZENEA1MEM0.86
BNSHYDROSULFONYLBENZENEA,D,E1FH00.86
BNSHYDROSULFONYLBENZENEA,B,C,D1PQ90.86
SMLPHENYL METHYL SULFONEA,I1D6W0.94
SMLPHENYL METHYL SULFONEA,I1D9I0.94
TSUPARA-TOLUENE SULFONATEA,B1WUW0.75
TSUPARA-TOLUENE SULFONATEA1B0D0.75
BT6benzenethiolA,B,C,D3HSR0.75
PTF[(METHYLSULFANYL)METHYL]BENZENEC,F1RHQ0.71