Compile Data Set for Download or QSAR
Found 11 Enz. Inhib. hit(s) with Target = '4-hydroxy-tetrahydrodipicolinate synthase'
Target4-hydroxy-tetrahydrodipicolinate synthase(Escherichia coli (strain K12))
University of Melbourne

Curated by ChEMBL
LigandPNGBDBM19472(2-oxoacetic acid | Glyoxylate | Oxoethanoic acid |...)
Show SMILES OC(=O)C=O
Show InChI InChI=1S/C2H2O3/c3-1-2(4)5/h1H,(H,4,5)
Affinity DataKi:  1.60E+4nMAssay Description:Inhibition of Escherichia coli DHDPSMore data for this Ligand-Target Pair
Target4-hydroxy-tetrahydrodipicolinate synthase(Bacillus subtilis)
University of Melbourne

Curated by ChEMBL
LigandPNGBDBM50273973(2,6-dioxoheptanedioic acid | CHEMBL451265)
Show SMILES OC(=O)C(=O)CCCC(=O)C(O)=O
Show InChI InChI=1S/C7H8O6/c8-4(6(10)11)2-1-3-5(9)7(12)13/h1-3H2,(H,10,11)(H,12,13)
Affinity DataKi:  1.60E+5nMAssay Description:Inhibition of Bacillus subtilis DHDPSMore data for this Ligand-Target Pair
Target4-hydroxy-tetrahydrodipicolinate synthase(Escherichia coli (strain K12))
University of Melbourne

Curated by ChEMBL
LigandPNGBDBM50160721(2-Oxo-heptanedioic acid | 2-oxoheptanedioic acid |...)
Show SMILES OC(=O)CCCCC(=O)C(O)=O
Show InChI InChI=1S/C7H10O5/c8-5(7(11)12)3-1-2-4-6(9)10/h1-4H2,(H,9,10)(H,11,12)
Affinity DataKi:  1.70E+5nMAssay Description:Binding affinity for Escherichia coli dihydrodipicolinate synthaseMore data for this Ligand-Target Pair
Target4-hydroxy-tetrahydrodipicolinate synthase(Escherichia coli (strain K12))
University of Melbourne

Curated by ChEMBL
LigandPNGBDBM50160721(2-Oxo-heptanedioic acid | 2-oxoheptanedioic acid |...)
Show SMILES OC(=O)CCCCC(=O)C(O)=O
Show InChI InChI=1S/C7H10O5/c8-5(7(11)12)3-1-2-4-6(9)10/h1-4H2,(H,9,10)(H,11,12)
Affinity DataKi:  1.70E+5nMAssay Description:Inhibition of Escherichia coli DHDPSMore data for this Ligand-Target Pair
Target4-hydroxy-tetrahydrodipicolinate synthase(Escherichia coli (strain K12))
University of Melbourne

Curated by ChEMBL
LigandPNGBDBM50273974(3-fluoro-2-oxopropanoate)
Show SMILES [O-]C(=O)C(=O)CF
Show InChI InChI=1S/C3H3FO3/c4-1-2(5)3(6)7/h1H2,(H,6,7)/p-1
Affinity DataKi:  2.20E+5nMAssay Description:Inhibition of Escherichia coli DHDPSMore data for this Ligand-Target Pair
Target4-hydroxy-tetrahydrodipicolinate synthase(Escherichia coli (strain K12))
University of Melbourne

Curated by ChEMBL
LigandPNGBDBM50273976(2-oxopentanoate | 2-oxovalerate | alpha-ketovalera...)
Show SMILES CCCC(=O)C([O-])=O
Show InChI InChI=1S/C5H8O3/c1-2-3-4(6)5(7)8/h2-3H2,1H3,(H,7,8)/p-1
Affinity DataKi:  7.00E+5nMAssay Description:Inhibition of Escherichia coli DHDPSMore data for this Ligand-Target Pair
Target4-hydroxy-tetrahydrodipicolinate synthase(Escherichia coli (strain K12))
University of Melbourne

Curated by ChEMBL
LigandPNGBDBM50273975(2-ketobutyrate | 2-oxobutanate | 2-oxobutanoate | ...)
Show SMILES CCC(=O)C([O-])=O
Show InChI InChI=1S/C4H6O3/c1-2-3(5)4(6)7/h2H2,1H3,(H,6,7)/p-1
Affinity DataKi:  8.30E+5nMAssay Description:Inhibition of Escherichia coli DHDPSMore data for this Ligand-Target Pair
Target4-hydroxy-tetrahydrodipicolinate synthase(Escherichia coli (strain K12))
University of Melbourne

Curated by ChEMBL
LigandPNGBDBM50412477(CHEMBL456159)
Show SMILES OC(=O)\C=C\C(=O)\C=C\C(O)=O
Show InChI InChI=1S/C7H6O5/c8-5(1-3-6(9)10)2-4-7(11)12/h1-4H,(H,9,10)(H,11,12)/b3-1+,4-2+
Affinity DataKi:  1.63E+6nMAssay Description:Inhibition of Escherichia coli recombinant DHDPS overexpressed with DHDPR assessed as residual activity by modified coupled assayMore data for this Ligand-Target Pair
Target4-hydroxy-tetrahydrodipicolinate synthase(Escherichia coli (strain K12))
University of Melbourne

Curated by ChEMBL
LigandPNGBDBM50412479(CHEMBL456197)
Show SMILES CCOC(=O)\C=C\C(=O)\C=C\C(=O)OCC
Show InChI InChI=1S/C11H14O5/c1-3-15-10(13)7-5-9(12)6-8-11(14)16-4-2/h5-8H,3-4H2,1-2H3/b7-5+,8-6+
Affinity DataKi:  4.95E+6nMAssay Description:Inhibition of Escherichia coli recombinant DHDPS overexpressed with DHDPR assessed as residual activity by modified coupled assayMore data for this Ligand-Target Pair
Target4-hydroxy-tetrahydrodipicolinate synthase(Escherichia coli (strain K12))
University of Melbourne

Curated by ChEMBL
LigandPNGBDBM50412478(CHEMBL178492)
Show SMILES CCOC(=O)CCC(=O)C=CC(=O)OCC
Show InChI InChI=1S/C11H16O5/c1-3-15-10(13)7-5-9(12)6-8-11(14)16-4-2/h5,7H,3-4,6,8H2,1-2H3
Affinity DataKi:  1.09E+7nMAssay Description:Inhibition of Escherichia coli recombinant DHDPS overexpressed with DHDPR assessed as residual activity by modified coupled assayMore data for this Ligand-Target Pair
Target4-hydroxy-tetrahydrodipicolinate synthase(Escherichia coli (strain K12))
University of Melbourne

Curated by ChEMBL
LigandPNGBDBM50412480(CHEMBL458071)
Show SMILES OC(=O)CCC(=O)C=CC(O)=O
Show InChI InChI=1S/C7H8O5/c8-5(1-3-6(9)10)2-4-7(11)12/h1,3H,2,4H2,(H,9,10)(H,11,12)
Affinity DataKi:  3.24E+7nMAssay Description:Inhibition of Escherichia coli recombinant DHDPS overexpressed with DHDPR assessed as residual activity by modified coupled assayMore data for this Ligand-Target Pair