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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00005409

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
BIHNAPHTHALENE-2,6-DISULFONIC ACIDA1U4S0.71
SMLPHENYL METHYL SULFONEA,I1D6W0.77
SMLPHENYL METHYL SULFONEA,I1D9I0.77
BNSHYDROSULFONYLBENZENE11YYY0.82
BNSHYDROSULFONYLBENZENEA1MEM0.82
BNSHYDROSULFONYLBENZENEA,D,E1FH00.82
BNSHYDROSULFONYLBENZENEA,B,C,D1PQ90.82
PVS(ethenylsulfonyl)benzeneA3BLU0.78
HS7N-oxo-2-(phenylsulfonylamino)ethanamideA3F1A0.72
BT6benzenethiolA,B,C,D3HSR0.72
PMBPARA-MERCURY-BENZENESULFONIC ACIDB1BH90.77
PMBPARA-MERCURY-BENZENESULFONIC ACIDH1HDK0.77
PMBPARA-MERCURY-BENZENESULFONIC ACIDA1HJ10.77
PMBPARA-MERCURY-BENZENESULFONIC ACIDA,B,C,D1YP20.77
PMBPARA-MERCURY-BENZENESULFONIC ACIDA1XZC0.77
TSUPARA-TOLUENE SULFONATEA,B1WUW0.7
TSUPARA-TOLUENE SULFONATEA1B0D0.7
MAJindane-5-sulfonamideA2QOA0.71
BPSA,B2DE40.72
FBT2,6-DIFLUOROBENZENESULFONAMIDEA1IF50.82
FBU3,5-DIFLUOROBENZENESULFONAMIDEA1IF60.82
FBS4-FLOUROBENZENESULFONAMIDEA1IF40.84
HS62-[(4-fluorophenyl)sulfonylamino]-
N-oxo-ethanamide
A3F190.7
NBBN-BUTYL-BENZENESULFONAMIDEA,B3D730.78
NBBN-BUTYL-BENZENESULFONAMIDEA3D770.78
NBBN-BUTYL-BENZENESULFONAMIDEA,B3D780.78
NBBN-BUTYL-BENZENESULFONAMIDEA,B3CZ10.78
NBBN-BUTYL-BENZENESULFONAMIDEA3D750.78
NBBN-BUTYL-BENZENESULFONAMIDEA3D760.78
NBBN-BUTYL-BENZENESULFONAMIDEA3BJH0.78
NBBN-BUTYL-BENZENESULFONAMIDEA,B3D740.78