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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00022834

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
PVS(ethenylsulfonyl)benzeneA3BLU0.89
FBT2,6-DIFLUOROBENZENESULFONAMIDEA1IF50.77
SMLPHENYL METHYL SULFONEA,I1D6W0.91
SMLPHENYL METHYL SULFONEA,I1D9I0.91
FBU3,5-DIFLUOROBENZENESULFONAMIDEA1IF60.77
PA0Phenylarsine oxideA3E3Z0.71
FBS4-FLOUROBENZENESULFONAMIDEA1IF40.8
TOSP-SULFINOTOLUENEH1ETT0.71
TOSP-SULFINOTOLUENEI4PAD0.71
TOSP-SULFINOTOLUENEA1EST0.71
TOSP-SULFINOTOLUENEC,G2CHA0.71
TOSP-SULFINOTOLUENEE1PPH0.71
NBBN-BUTYL-BENZENESULFONAMIDEA,B3D730.71
NBBN-BUTYL-BENZENESULFONAMIDEA3D770.71
NBBN-BUTYL-BENZENESULFONAMIDEA,B3D780.71
NBBN-BUTYL-BENZENESULFONAMIDEA,B3CZ10.71
NBBN-BUTYL-BENZENESULFONAMIDEA3D750.71
NBBN-BUTYL-BENZENESULFONAMIDEA3D760.71
NBBN-BUTYL-BENZENESULFONAMIDEA3BJH0.71
NBBN-BUTYL-BENZENESULFONAMIDEA,B3D740.71
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
PBCPHENYL BORONIC ACIDA2A320.71
PBCPHENYL BORONIC ACIDA1JU30.71
BT6benzenethiolA,B,C,D3HSR0.78
BNSHYDROSULFONYLBENZENE11YYY0.89
BNSHYDROSULFONYLBENZENEA1MEM0.89
BNSHYDROSULFONYLBENZENEA,D,E1FH00.89
BNSHYDROSULFONYLBENZENEA,B,C,D1PQ90.89