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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02862658

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
FBU3,5-DIFLUOROBENZENESULFONAMIDEA1IF60.78
FBT2,6-DIFLUOROBENZENESULFONAMIDEA1IF50.78
BT6benzenethiolA,B,C,D3HSR0.71
BNSHYDROSULFONYLBENZENE11YYY0.81
BNSHYDROSULFONYLBENZENEA1MEM0.81
BNSHYDROSULFONYLBENZENEA,D,E1FH00.81
BNSHYDROSULFONYLBENZENEA,B,C,D1PQ90.81
BBS4-TERT-BUTYLBENZENESULFONIC ACIDB1EOJ0.7
BBS4-TERT-BUTYLBENZENESULFONIC ACIDB1EOL0.7
PVS(ethenylsulfonyl)benzeneA3BLU0.77
FBS4-FLOUROBENZENESULFONAMIDEA1IF40.78
SMLPHENYL METHYL SULFONEA,I1D6W0.76
SMLPHENYL METHYL SULFONEA,I1D9I0.76
TOSP-SULFINOTOLUENEH1ETT0.72
TOSP-SULFINOTOLUENEI4PAD0.72
TOSP-SULFINOTOLUENEA1EST0.72
TOSP-SULFINOTOLUENEC,G2CHA0.72
TOSP-SULFINOTOLUENEE1PPH0.72
TSUPARA-TOLUENE SULFONATEA,B1WUW0.73
TSUPARA-TOLUENE SULFONATEA1B0D0.73
NBBN-BUTYL-BENZENESULFONAMIDEA,B3D730.7
NBBN-BUTYL-BENZENESULFONAMIDEA3D770.7
NBBN-BUTYL-BENZENESULFONAMIDEA,B3D780.7
NBBN-BUTYL-BENZENESULFONAMIDEA,B3CZ10.7
NBBN-BUTYL-BENZENESULFONAMIDEA3D750.7
NBBN-BUTYL-BENZENESULFONAMIDEA3D760.7
NBBN-BUTYL-BENZENESULFONAMIDEA3BJH0.7
NBBN-BUTYL-BENZENESULFONAMIDEA,B3D740.7