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Found 10 hits Enz. Inhib. hit(s) with Target = '3-oxoacyl-(Acyl-carrier protein) reductase'   
Target
(Institution)
LigandTarget
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
3-oxoacyl-(Acyl-carrier protein) reductase


(Plasmodium falciparum (isolate 3D7))
BDBM50070942
PNG
((-)-Epigallocatechin gallate | (-)-Epigallocatechi...)
Show SMILES Oc1cc(O)c2C[C@@H](OC(=O)c3cc(O)c(O)c(O)c3)[C@H](Oc2c1)c1cc(O)c(O)c(O)c1
Show InChI InChI=1S/C22H18O11/c23-10-5-12(24)11-7-18(33-22(31)9-3-15(27)20(30)16(28)4-9)21(32-17(11)6-10)8-1-13(25)19(29)14(26)2-8/h1-6,18,21,23-30H,7H2/t18-,21-/m1/s1
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n/an/a 320n/an/an/an/an/an/a



University of Bologna

Curated by ChEMBL


Assay Description
Inhibition of recombinant Plasmodium falciparum 3D7 FabG using acetoacetyl-CoA as substrate after 10 mins in presence of NADPH


Citation and Details
More data for this
Ligand-Target Pair
3-oxoacyl-(Acyl-carrier protein) reductase


(Plasmodium falciparum (isolate 3D7))
BDBM50440620
PNG
(CHEMBL2426552)
Show SMILES Oc1ccc2cc(Oc3ccc(Cl)cc3O)c(=O)oc2c1
Show InChI InChI=1S/C15H9ClO5/c16-9-2-4-12(11(18)6-9)20-14-5-8-1-3-10(17)7-13(8)21-15(14)19/h1-7,17-18H
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n/an/a 9.90E+4n/an/an/an/an/an/a



University of Bologna

Curated by ChEMBL


Assay Description
Inhibition of recombinant Plasmodium falciparum 3D7 FabG using acetoacetyl-CoA as substrate after 10 mins in presence of NADPH


Citation and Details
More data for this
Ligand-Target Pair
3-oxoacyl-(Acyl-carrier protein) reductase


(Plasmodium falciparum (isolate 3D7))
BDBM50440621
PNG
(CHEMBL2426554)
Show SMILES Cc1c(Oc2ccc(Cl)cc2O)c(=O)oc2ccccc12
Show InChI InChI=1S/C16H11ClO4/c1-9-11-4-2-3-5-13(11)21-16(19)15(9)20-14-7-6-10(17)8-12(14)18/h2-8,18H,1H3
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n/an/a>1.00E+5n/an/an/an/an/an/a



University of Bologna

Curated by ChEMBL


Assay Description
Inhibition of recombinant Plasmodium falciparum 3D7 FabG using acetoacetyl-CoA as substrate after 10 mins in presence of NADPH


Citation and Details
More data for this
Ligand-Target Pair
3-oxoacyl-(Acyl-carrier protein) reductase


(Plasmodium falciparum (isolate 3D7))
BDBM50440623
PNG
(CHEMBL2426551)
Show SMILES Oc1ccc2oc(=O)c(Oc3ccc(Cl)cc3O)cc2c1
Show InChI InChI=1S/C15H9ClO5/c16-9-1-3-13(11(18)7-9)20-14-6-8-5-10(17)2-4-12(8)21-15(14)19/h1-7,17-18H
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n/an/a>1.00E+5n/an/an/an/an/an/a



University of Bologna

Curated by ChEMBL


Assay Description
Inhibition of recombinant Plasmodium falciparum 3D7 FabG using acetoacetyl-CoA as substrate after 10 mins in presence of NADPH


Citation and Details
More data for this
Ligand-Target Pair
3-oxoacyl-(Acyl-carrier protein) reductase


(Plasmodium falciparum (isolate 3D7))
BDBM50440624
PNG
(CHEMBL2426550)
Show SMILES Oc1cc(Cl)ccc1Oc1cc2ccccc2oc1=O
Show InChI InChI=1S/C15H9ClO4/c16-10-5-6-13(11(17)8-10)19-14-7-9-3-1-2-4-12(9)20-15(14)18/h1-8,17H
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n/an/a>1.00E+5n/an/an/an/an/an/a



University of Bologna

Curated by ChEMBL


Assay Description
Inhibition of recombinant Plasmodium falciparum 3D7 FabG using acetoacetyl-CoA as substrate after 10 mins in presence of NADPH


Citation and Details
More data for this
Ligand-Target Pair
3-oxoacyl-(Acyl-carrier protein) reductase


(Plasmodium falciparum (isolate 3D7))
BDBM50440625
PNG
(CHEMBL2426549)
Show SMILES CCc1cc(=O)oc2cc(Oc3ccc(Cl)cc3O)ccc12
Show InChI InChI=1S/C17H13ClO4/c1-2-10-7-17(20)22-16-9-12(4-5-13(10)16)21-15-6-3-11(18)8-14(15)19/h3-9,19H,2H2,1H3
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n/an/a>1.00E+5n/an/an/an/an/an/a



University of Bologna

Curated by ChEMBL


Assay Description
Inhibition of recombinant Plasmodium falciparum 3D7 FabG using acetoacetyl-CoA as substrate after 10 mins in presence of NADPH


Citation and Details
More data for this
Ligand-Target Pair
3-oxoacyl-(Acyl-carrier protein) reductase


(Plasmodium falciparum (isolate 3D7))
BDBM50440626
PNG
(CHEMBL2426548)
Show SMILES Cc1cc(=O)oc2cc(Oc3ccc(Cl)cc3O)ccc12
Show InChI InChI=1S/C16H11ClO4/c1-9-6-16(19)21-15-8-11(3-4-12(9)15)20-14-5-2-10(17)7-13(14)18/h2-8,18H,1H3
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n/an/a>1.00E+5n/an/an/an/an/an/a



University of Bologna

Curated by ChEMBL


Assay Description
Inhibition of recombinant Plasmodium falciparum 3D7 FabG using acetoacetyl-CoA as substrate after 10 mins in presence of NADPH


Citation and Details
More data for this
Ligand-Target Pair
3-oxoacyl-(Acyl-carrier protein) reductase


(Plasmodium falciparum (isolate 3D7))
BDBM50440619
PNG
(CHEMBL2426555)
Show SMILES Cc1c(Oc2ccc(Cl)cc2O)c(=O)oc2cc(O)ccc12
Show InChI InChI=1S/C16H11ClO5/c1-8-11-4-3-10(18)7-14(11)22-16(20)15(8)21-13-5-2-9(17)6-12(13)19/h2-7,18-19H,1H3
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n/an/a>1.00E+5n/an/an/an/an/an/a



University of Bologna

Curated by ChEMBL


Assay Description
Inhibition of recombinant Plasmodium falciparum 3D7 FabG using acetoacetyl-CoA as substrate after 10 mins in presence of NADPH


Citation and Details
More data for this
Ligand-Target Pair
3-oxoacyl-(Acyl-carrier protein) reductase


(Plasmodium falciparum (isolate 3D7))
BDBM50440622
PNG
(CHEMBL2426556)
Show SMILES Oc1ccc2cc(-c3ccc(Oc4ccc(Cl)cc4O)cc3)c(=O)oc2c1
Show InChI InChI=1S/C21H13ClO5/c22-14-4-8-19(18(24)10-14)26-16-6-2-12(3-7-16)17-9-13-1-5-15(23)11-20(13)27-21(17)25/h1-11,23-24H
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University of Bologna

Curated by ChEMBL


Assay Description
Inhibition of recombinant Plasmodium falciparum 3D7 FabG using acetoacetyl-CoA as substrate after 10 mins in presence of NADPH


Citation and Details
More data for this
Ligand-Target Pair
3-oxoacyl-(Acyl-carrier protein) reductase


(Plasmodium falciparum (isolate 3D7))
BDBM50440627
PNG
(CHEMBL2426553)
Show SMILES Oc1cc(O)c2cc(Oc3ccc(Cl)cc3O)c(=O)oc2c1
Show InChI InChI=1S/C15H9ClO6/c16-7-1-2-12(11(19)3-7)21-14-6-9-10(18)4-8(17)5-13(9)22-15(14)20/h1-6,17-19H
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University of Bologna

Curated by ChEMBL


Assay Description
Inhibition of recombinant Plasmodium falciparum 3D7 FabG using acetoacetyl-CoA as substrate after 10 mins in presence of NADPH


Citation and Details
More data for this
Ligand-Target Pair