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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00019666

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
PVS(ethenylsulfonyl)benzeneA3BLU0.85
PMBPARA-MERCURY-BENZENESULFONIC ACIDB1BH90.71
PMBPARA-MERCURY-BENZENESULFONIC ACIDH1HDK0.71
PMBPARA-MERCURY-BENZENESULFONIC ACIDA1HJ10.71
PMBPARA-MERCURY-BENZENESULFONIC ACIDA,B,C,D1YP20.71
PMBPARA-MERCURY-BENZENESULFONIC ACIDA1XZC0.71
AL5THIOPHENE-2,5-DISULFONIC ACID 2-
AMIDE-5-(4-METHYL-BENZYLAMIDE)
A1BN10.71
BZBBENZO[B]THIOPHENE-2-BORONIC ACIDA,B3FKV0.73
BZBBENZO[B]THIOPHENE-2-BORONIC ACIDA,B1C3B0.73
TDB6-METHYL-2(PROPANE-1-SULFONYL)-
2H-THIENO[3,2-D][1,2,3]DIAZABORININ-
1-OL
A,B1DFH0.73
TDB6-METHYL-2(PROPANE-1-SULFONYL)-
2H-THIENO[3,2-D][1,2,3]DIAZABORININ-
1-OL
A,B1CWU0.73
SMLPHENYL METHYL SULFONEA,I1D6W0.81
SMLPHENYL METHYL SULFONEA,I1D9I0.81
ETP3-(4-BENZENESULFONYL-THIOPHENE-
2-SULFONYLAMINO)-PHENYLBORONIC ACID
A,B1GA90.71
BNSHYDROSULFONYLBENZENE11YYY0.74
BNSHYDROSULFONYLBENZENEA1MEM0.74
BNSHYDROSULFONYLBENZENEA,D,E1FH00.74
BNSHYDROSULFONYLBENZENEA,B,C,D1PQ90.74
TPDN-(2-THIENYLMETHYL)-2,5-THIOPHENEDISULFONAMIDEA1BNW0.73