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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02636024

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
MAJindane-5-sulfonamideA2QOA0.74
PA0Phenylarsine oxideA3E3Z0.71
NBBN-BUTYL-BENZENESULFONAMIDEA,B3D730.81
NBBN-BUTYL-BENZENESULFONAMIDEA3D770.81
NBBN-BUTYL-BENZENESULFONAMIDEA,B3D780.81
NBBN-BUTYL-BENZENESULFONAMIDEA,B3CZ10.81
NBBN-BUTYL-BENZENESULFONAMIDEA3D750.81
NBBN-BUTYL-BENZENESULFONAMIDEA3D760.81
NBBN-BUTYL-BENZENESULFONAMIDEA3BJH0.81
NBBN-BUTYL-BENZENESULFONAMIDEA,B3D740.81
TOSP-SULFINOTOLUENEH1ETT0.71
TOSP-SULFINOTOLUENEI4PAD0.71
TOSP-SULFINOTOLUENEA1EST0.71
TOSP-SULFINOTOLUENEC,G2CHA0.71
TOSP-SULFINOTOLUENEE1PPH0.71
ZYX4-(2-AMINOETHYL)BENZENESULFONAMIDEA2NNG0.7
AMS3-MERCURI-4-AMINOBENZENESULFONAMIDEA3CA20.7
HS7N-oxo-2-(phenylsulfonylamino)ethanamideA3F1A0.72
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
FBU3,5-DIFLUOROBENZENESULFONAMIDEA1IF60.88
FBT2,6-DIFLUOROBENZENESULFONAMIDEA1IF50.88
TSUPARA-TOLUENE SULFONATEA,B1WUW0.72
TSUPARA-TOLUENE SULFONATEA1B0D0.72
I7A4,5-DICHLOROBENZENE-1,3-DISULFONAMIDEA2POU0.71
PBCPHENYL BORONIC ACIDA2A320.71
PBCPHENYL BORONIC ACIDA1JU30.71
BT6benzenethiolA,B,C,D3HSR0.78
FBS4-FLOUROBENZENESULFONAMIDEA1IF40.91
SMLPHENYL METHYL SULFONEA,I1D6W0.8
SMLPHENYL METHYL SULFONEA,I1D9I0.8
BNSHYDROSULFONYLBENZENE11YYY0.89
BNSHYDROSULFONYLBENZENEA1MEM0.89
BNSHYDROSULFONYLBENZENEA,D,E1FH00.89
BNSHYDROSULFONYLBENZENEA,B,C,D1PQ90.89
PIHIODOPHENYLA1UO50.74
PIHIODOPHENYLA3DNA0.74
PIHIODOPHENYLA1F9O0.74
PIHIODOPHENYLA,B1UO40.74
PIHIODOPHENYLA3DN40.74
PVS(ethenylsulfonyl)benzeneA3BLU0.79
HS62-[(4-fluorophenyl)sulfonylamino]-
N-oxo-ethanamide
A3F190.7