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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00698431

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
DMBA,B1SRI0.72
3CAA,B2B770.7
1BA4-HYDROXY-N'-(4-ISOPROPYLBENZYL)BENZOHYDRAZIDEA2GPP0.78
HABA,B1SRE0.74
4AA4-CHLORO-3-HYDROXYANTHRANILIC ACIDA1YFW0.71
4AA4-CHLORO-3-HYDROXYANTHRANILIC ACIDA1YFX0.71
136N-(4-CARBAMIMIDOYL-3-CHORO-PHENYL)-
2-HYDROXY-3-IODO-5-METHYL-BENZAMIDE
B1GJD0.72
CHP3-CHLORO-4-HYDROXYPHENYLGLYCINEA1DSR0.74
MHBA,B1SRG0.74
2BE4-chloro-N'-[(1E)-(3,5-dibromo-
2,4-dihydroxyphenyl)methylidene]benzohydrazide
A,B,C,D,E,F3DOY0.75
MTBA,B1SRF0.71
135N-(4-CARBAMIMIDOYL-PHENYL)-2-HYDROXY-
BENZAMIDE
B1GJA0.71
P2C2-[(3,5-DICHLORO-4-TRIOXIDANYLPHENYL)AMINO]BENZOIC ACIDA,B1U210.72
HBD4-HYDROXYBENZAMIDEB,C,D1BEN0.75
SCLACETIC ACID SALICYLOYL-AMINO-ESTERA1EBV0.75
YE65-(2-chlorophenyl)furan-2-carbohydrazideA2P9A0.72
YE65-(2-chlorophenyl)furan-2-carbohydrazideA2P990.72
FE34-(2-aminoethyl)-3-chlorobenzoic acidA,B2K1Q0.7
DZ22,5-dichloro-N-(3,5-dibromo-4-hydroxyphenyl)benzamideA,B3ESO0.71
SGI3-(4-hydroxyphenyl)propanamideA,B2R9K0.7
SHASALICYLHYDROXAMIC ACIDX1V0H0.76
SHASALICYLHYDROXAMIC ACIDA2QPK0.76
SHASALICYLHYDROXAMIC ACIDA3FNL0.76
SHASALICYLHYDROXAMIC ACIDA3GCJ0.76
SHASALICYLHYDROXAMIC ACIDA1CK60.76