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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs01385765

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
DB12,3-DIHYDROXYBENZAMIDEA,B,C1X710.73
1592-HYDROXY-5-(2-MERCAPTO-ETHYLSULFAMOYL)-
BENZOIC ACID
A,B1NME0.8
1BA4-HYDROXY-N'-(4-ISOPROPYLBENZYL)BENZOHYDRAZIDEA2GPP0.78
5PH5-[5-(1-CARBOXYMETHYL-2-OXO-PROPYLCARBAMOYL)-
5-PHENYL-PENTYLSULFAMOYL]-2-HYDROXY-
BENZOIC ACID
A1RWV0.77
SCLACETIC ACID SALICYLOYL-AMINO-ESTERA1EBV0.76
HBD4-HYDROXYBENZAMIDEB,C,D1BEN0.71
GAJN-TETRAZOL-5-YL 9-OXO-9H-XANTHENE-
2 SULPHONAMIDE
A2C4W0.7
BFSN-[1-(4-BROMOPHENYL)ETHYL]-5-FLUORO SALICYLAMIDEA1STD0.7
BFSN-[1-(4-BROMOPHENYL)ETHYL]-5-FLUORO SALICYLAMIDEA,B,C4STD0.7
1615-[4-(1-CARBOXYMETHYL-2-OXO-PROPYLCARBAMOYL)-
BENZYLSULFAMOYL]-2-HYDROXY-BENZOIC ACID
A,B1NMS0.8
SHASALICYLHYDROXAMIC ACIDX1V0H0.76
SHASALICYLHYDROXAMIC ACIDA2QPK0.76
SHASALICYLHYDROXAMIC ACIDA3FNL0.76
SHASALICYLHYDROXAMIC ACIDA3GCJ0.76
SHASALICYLHYDROXAMIC ACIDA1CK60.76
ECAN,N',N''-[BENZENE-1,3,5-TRIYLTRIS(METHYLENE)]TRIS(2,3-
DIHYDROXYBENZAMIDE)
A,B2CHU0.71