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Found 48 hits Enz. Inhib. hit(s) with Target = 'Enoyl-acyl carrier reductase' AND taxid = 5811   
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
Enoyl-acyl carrier reductase


(Toxoplasma gondii)
BDBM50174768
PNG
(5‐chloro‐2‐(2‐chloro‐...)
Show SMILES Oc1ccc(Oc2ccc(Cl)cc2O)c(Cl)c1
Show InChI InChI=1S/C12H8Cl2O3/c13-7-1-3-12(10(16)5-7)17-11-4-2-8(15)6-9(11)14/h1-6,15-16H
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n/an/a 3n/an/an/an/an/an/a



Johns Hopkins Bloomberg School of Public Health



Assay Description
The reaction mixture (100 µL) contained 100 µM crotonyl-CoA, 1 µL DMSO (or compounds dissolved in DMSO), 5 nM TgENR, 100 mM sodium/pot...


Citation and Details
More data for this
Ligand-Target Pair
Enoyl-acyl carrier reductase


(Toxoplasma gondii)
BDBM25407
PNG
(2‐(2,4‐dichlorophenoxy)‐5‐...)
Show SMILES CCc1ccc(Oc2ccc(Cl)cc2Cl)c(O)c1
Show InChI InChI=1S/C14H12Cl2O2/c1-2-9-3-5-14(12(17)7-9)18-13-6-4-10(15)8-11(13)16/h3-8,17H,2H2,1H3
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n/an/a 8n/an/an/an/an/an/a



Johns Hopkins Bloomberg School of Public Health



Assay Description
The reaction mixture (100 µL) contained 100 µM crotonyl-CoA, 1 µL DMSO (or compounds dissolved in DMSO), 5 nM TgENR, 100 mM sodium/pot...


Citation and Details
More data for this
Ligand-Target Pair
Enoyl-acyl carrier reductase


(Toxoplasma gondii)
BDBM50174760
PNG
(2‐[4‐(benzylamino)‐2‐chlor...)
Show SMILES Oc1cc(Cl)ccc1Oc1ccc(NCc2ccccc2)cc1Cl
Show InChI InChI=1S/C19H15Cl2NO2/c20-14-6-8-19(17(23)10-14)24-18-9-7-15(11-16(18)21)22-12-13-4-2-1-3-5-13/h1-11,22-23H,12H2
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n/an/a 13n/an/an/an/an/an/a



Johns Hopkins Bloomberg School of Public Health



Assay Description
The reaction mixture (100 µL) contained 100 µM crotonyl-CoA, 1 µL DMSO (or compounds dissolved in DMSO), 5 nM TgENR, 100 mM sodium/pot...


Citation and Details
More data for this
Ligand-Target Pair
Enoyl-acyl carrier reductase


(Toxoplasma gondii)
BDBM8726
PNG
(5-chloro-2-(2,4-dichlorophenoxy)phenol | CHEMBL849...)
Show SMILES Oc1cc(Cl)ccc1Oc1ccc(Cl)cc1Cl
Show InChI InChI=1S/C12H7Cl3O2/c13-7-1-3-11(9(15)5-7)17-12-4-2-8(14)6-10(12)16/h1-6,16H
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n/an/a 15n/an/an/an/an/an/a



University of Leeds

Curated by ChEMBL


Assay Description
Inhibition of Toxoplasma gondii enoyl acyl-carrier protein reductase


Citation and Details
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Enoyl-acyl carrier reductase


(Toxoplasma gondii)
BDBM8726
PNG
(5-chloro-2-(2,4-dichlorophenoxy)phenol | CHEMBL849...)
Show SMILES Oc1cc(Cl)ccc1Oc1ccc(Cl)cc1Cl
Show InChI InChI=1S/C12H7Cl3O2/c13-7-1-3-11(9(15)5-7)17-12-4-2-8(14)6-10(12)16/h1-6,16H
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n/an/a 15n/an/an/an/an/an/a



Johns Hopkins Bloomberg School of Public Health



Assay Description
The reaction mixture (100 µL) contained 100 µM crotonyl-CoA, 1 µL DMSO (or compounds dissolved in DMSO), 5 nM TgENR, 100 mM sodium/pot...


Citation and Details
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Enoyl-acyl carrier reductase


(Toxoplasma gondii)
BDBM8726
PNG
(5-chloro-2-(2,4-dichlorophenoxy)phenol | CHEMBL849...)
Show SMILES Oc1cc(Cl)ccc1Oc1ccc(Cl)cc1Cl
Show InChI InChI=1S/C12H7Cl3O2/c13-7-1-3-11(9(15)5-7)17-12-4-2-8(14)6-10(12)16/h1-6,16H
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n/an/a 15n/an/an/an/an/an/a



University of Illinois at Chicago

Curated by ChEMBL


Assay Description
Inhibition of Toxoplasma gondii enoyl reductase assessed as conversion of trans-2-acyl-ACP to acyl-ACP


Citation and Details
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Enoyl-acyl carrier reductase


(Toxoplasma gondii)
BDBM50174774
PNG
(2‐({[3‐chloro‐4‐(4‐c...)
Show SMILES Oc1cc(Cl)ccc1Oc1ccc(NCc2ccccc2C#N)cc1Cl
Show InChI InChI=1S/C20H14Cl2N2O2/c21-15-5-7-20(18(25)9-15)26-19-8-6-16(10-17(19)22)24-12-14-4-2-1-3-13(14)11-23/h1-10,24-25H,12H2
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n/an/a 16n/an/an/an/an/an/a



Johns Hopkins Bloomberg School of Public Health



Assay Description
The reaction mixture (100 µL) contained 100 µM crotonyl-CoA, 1 µL DMSO (or compounds dissolved in DMSO), 5 nM TgENR, 100 mM sodium/pot...


Citation and Details
More data for this
Ligand-Target Pair
Enoyl-acyl carrier reductase


(Toxoplasma gondii)
BDBM119865
PNG
(6‐chloro‐3‐(2,4‐dichloroph...)
Show SMILES Oc1c(Oc2ccc(Cl)cc2Cl)ccc(Cl)c1C#N
Show InChI InChI=1S/C13H6Cl3NO2/c14-7-1-3-11(10(16)5-7)19-12-4-2-9(15)8(6-17)13(12)18/h1-5,18H
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n/an/a 18n/an/an/an/an/an/a



Johns Hopkins Bloomberg School of Public Health



Assay Description
The reaction mixture (100 µL) contained 100 µM crotonyl-CoA, 1 µL DMSO (or compounds dissolved in DMSO), 5 nM TgENR, 100 mM sodium/pot...


Citation and Details
More data for this
Ligand-Target Pair
Enoyl-acyl carrier reductase


(Toxoplasma gondii)
BDBM50435717
PNG
(CHEMBL2392450 | N‐{[4‐(2,4‐dichl...)
Show SMILES Cc1cc(no1)C(=O)NCc1ccc(Oc2ccc(Cl)cc2Cl)c(O)c1
Show InChI InChI=1S/C18H14Cl2N2O4/c1-10-6-14(22-26-10)18(24)21-9-11-2-4-17(15(23)7-11)25-16-5-3-12(19)8-13(16)20/h2-8,23H,9H2,1H3,(H,21,24)
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n/an/a 19n/an/an/an/an/an/a



Johns Hopkins Bloomberg School of Public Health



Assay Description
The reaction mixture (100 µL) contained 100 µM crotonyl-CoA, 1 µL DMSO (or compounds dissolved in DMSO), 5 nM TgENR, 100 mM sodium/pot...


Citation and Details
More data for this
Ligand-Target Pair
Enoyl-acyl carrier reductase


(Toxoplasma gondii)
BDBM50435717
PNG
(CHEMBL2392450 | N‐{[4‐(2,4‐dichl...)
Show SMILES Cc1cc(no1)C(=O)NCc1ccc(Oc2ccc(Cl)cc2Cl)c(O)c1
Show InChI InChI=1S/C18H14Cl2N2O4/c1-10-6-14(22-26-10)18(24)21-9-11-2-4-17(15(23)7-11)25-16-5-3-12(19)8-13(16)20/h2-8,23H,9H2,1H3,(H,21,24)
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n/an/a 19n/an/an/an/an/an/a



University of Leeds

Curated by ChEMBL


Assay Description
Inhibition of Toxoplasma gondii enoyl acyl-carrier protein reductase


Citation and Details
More data for this
Ligand-Target Pair
Enoyl-acyl carrier reductase


(Toxoplasma gondii)
BDBM119866
PNG
(3‐chloro‐6‐(2,4‐dichloroph...)
Show SMILES OCc1c(O)c(Oc2ccc(Cl)cc2Cl)ccc1Cl
Show InChI InChI=1S/C13H9Cl3O3/c14-7-1-3-11(10(16)5-7)19-12-4-2-9(15)8(6-17)13(12)18/h1-5,17-18H,6H2
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n/an/a 23n/an/an/an/an/an/a



Johns Hopkins Bloomberg School of Public Health



Assay Description
The reaction mixture (100 µL) contained 100 µM crotonyl-CoA, 1 µL DMSO (or compounds dissolved in DMSO), 5 nM TgENR, 100 mM sodium/pot...


Citation and Details
More data for this
Ligand-Target Pair
Enoyl-acyl carrier reductase


(Toxoplasma gondii)
BDBM25403
PNG
(4‐(2,4‐dichlorophenoxy)‐3‐...)
Show SMILES Oc1cc(ccc1Oc1ccc(Cl)cc1Cl)C#N
Show InChI InChI=1S/C13H7Cl2NO2/c14-9-2-4-12(10(15)6-9)18-13-3-1-8(7-16)5-11(13)17/h1-6,17H
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n/an/a 24n/an/an/an/an/an/a



Johns Hopkins Bloomberg School of Public Health



Assay Description
The reaction mixture (100 µL) contained 100 µM crotonyl-CoA, 1 µL DMSO (or compounds dissolved in DMSO), 5 nM TgENR, 100 mM sodium/pot...


Citation and Details
More data for this
Ligand-Target Pair
Enoyl-acyl carrier reductase


(Toxoplasma gondii)
BDBM119867
PNG
(5‐chloro‐2‐[2‐chloro‐...)
Show SMILES Oc1cc(Cl)ccc1Oc1ccc(Cn2ccnn2)cc1Cl
Show InChI InChI=1S/C15H11Cl2N3O2/c16-11-2-4-15(13(21)8-11)22-14-3-1-10(7-12(14)17)9-20-6-5-18-19-20/h1-8,21H,9H2
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n/an/a 26n/an/an/an/an/an/a



Johns Hopkins Bloomberg School of Public Health



Assay Description
The reaction mixture (100 µL) contained 100 µM crotonyl-CoA, 1 µL DMSO (or compounds dissolved in DMSO), 5 nM TgENR, 100 mM sodium/pot...


Citation and Details
More data for this
Ligand-Target Pair
Enoyl-acyl carrier reductase


(Toxoplasma gondii)
BDBM50435720
PNG
(CHEMBL2392447)
Show SMILES CCCc1cc(no1)-c1ccc(Oc2ccc(cc2O)C#N)c(Cl)c1
Show InChI InChI=1S/C19H15ClN2O3/c1-2-3-14-10-16(22-25-14)13-5-7-18(15(20)9-13)24-19-6-4-12(11-21)8-17(19)23/h4-10,23H,2-3H2,1H3
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n/an/a 29n/an/an/an/an/an/a



University of Leeds

Curated by ChEMBL


Assay Description
Inhibition of Toxoplasma gondii enoyl acyl-carrier protein reductase


Citation and Details
More data for this
Ligand-Target Pair
Enoyl-acyl carrier reductase


(Toxoplasma gondii)
BDBM50431922
PNG
(5‐chloro‐2‐[2‐chloro‐...)
Show SMILES Oc1cc(Cl)ccc1Oc1ccc(cc1Cl)C(F)(F)F
Show InChI InChI=1S/C13H7Cl2F3O2/c14-8-2-4-12(10(19)6-8)20-11-3-1-7(5-9(11)15)13(16,17)18/h1-6,19H
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n/an/a 30n/an/an/an/an/an/a



Johns Hopkins Bloomberg School of Public Health



Assay Description
The reaction mixture (100 µL) contained 100 µM crotonyl-CoA, 1 µL DMSO (or compounds dissolved in DMSO), 5 nM TgENR, 100 mM sodium/pot...


Citation and Details
More data for this
Ligand-Target Pair
Enoyl-acyl carrier reductase


(Toxoplasma gondii)
BDBM50431922
PNG
(5‐chloro‐2‐[2‐chloro‐...)
Show SMILES Oc1cc(Cl)ccc1Oc1ccc(cc1Cl)C(F)(F)F
Show InChI InChI=1S/C13H7Cl2F3O2/c14-8-2-4-12(10(19)6-8)20-11-3-1-7(5-9(11)15)13(16,17)18/h1-6,19H
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n/an/a 30n/an/an/an/an/an/a



University of Illinois at Chicago

Curated by ChEMBL


Assay Description
Inhibition of Toxoplasma gondii enoyl reductase assessed as conversion of trans-2-acyl-ACP to acyl-ACP


Citation and Details
More data for this
Ligand-Target Pair
Enoyl-acyl carrier reductase


(Toxoplasma gondii)
BDBM119869
PNG
(5‐chloro‐2‐{2‐chloro‐...)
Show SMILES Oc1cc(Cl)ccc1Oc1ccc(CNc2ccccc2)cc1Cl
Show InChI InChI=1S/C19H15Cl2NO2/c20-14-7-9-19(17(23)11-14)24-18-8-6-13(10-16(18)21)12-22-15-4-2-1-3-5-15/h1-11,22-23H,12H2
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n/an/a 31n/an/an/an/an/an/a



Johns Hopkins Bloomberg School of Public Health



Assay Description
The reaction mixture (100 µL) contained 100 µM crotonyl-CoA, 1 µL DMSO (or compounds dissolved in DMSO), 5 nM TgENR, 100 mM sodium/pot...


Citation and Details
More data for this
Ligand-Target Pair
Enoyl-acyl carrier reductase


(Toxoplasma gondii)
BDBM119870
PNG
(N‐{[3‐chloro‐4‐(4‐ch...)
Show SMILES Cc1cc(CC(=O)NCc2ccc(Oc3ccc(Cl)cc3O)c(Cl)c2)on1
Show InChI InChI=1S/C19H16Cl2N2O4/c1-11-6-14(27-23-11)9-19(25)22-10-12-2-4-17(15(21)7-12)26-18-5-3-13(20)8-16(18)24/h2-8,24H,9-10H2,1H3,(H,22,25)
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n/an/a 33n/an/an/an/an/an/a



Johns Hopkins Bloomberg School of Public Health



Assay Description
The reaction mixture (100 µL) contained 100 µM crotonyl-CoA, 1 µL DMSO (or compounds dissolved in DMSO), 5 nM TgENR, 100 mM sodium/pot...


Citation and Details
More data for this
Ligand-Target Pair
Enoyl-acyl carrier reductase


(Toxoplasma gondii)
BDBM50435719
PNG
(CHEMBL2392448)
Show SMILES OCCc1cc(no1)-c1ccc(Oc2ccc(cc2O)C#N)c(Cl)c1
Show InChI InChI=1S/C18H13ClN2O4/c19-14-8-12(15-9-13(5-6-22)25-21-15)2-4-17(14)24-18-3-1-11(10-20)7-16(18)23/h1-4,7-9,22-23H,5-6H2
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n/an/a 34n/an/an/an/an/an/a



University of Leeds

Curated by ChEMBL


Assay Description
Inhibition of Toxoplasma gondii enoyl acyl-carrier protein reductase


Citation and Details
More data for this
Ligand-Target Pair
Enoyl-acyl carrier reductase


(Toxoplasma gondii)
BDBM50431923
PNG
(5‐chloro‐2‐(naphthalen‐2&#...)
Show SMILES Oc1cc(Cl)ccc1Oc1ccc2ccccc2c1
Show InChI InChI=1S/C16H11ClO2/c17-13-6-8-16(15(18)10-13)19-14-7-5-11-3-1-2-4-12(11)9-14/h1-10,18H
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n/an/a 41n/an/an/an/an/an/a



Johns Hopkins Bloomberg School of Public Health



Assay Description
The reaction mixture (100 µL) contained 100 µM crotonyl-CoA, 1 µL DMSO (or compounds dissolved in DMSO), 5 nM TgENR, 100 mM sodium/pot...


Citation and Details
More data for this
Ligand-Target Pair
Enoyl-acyl carrier reductase


(Toxoplasma gondii)
BDBM50431923
PNG
(5‐chloro‐2‐(naphthalen‐2&#...)
Show SMILES Oc1cc(Cl)ccc1Oc1ccc2ccccc2c1
Show InChI InChI=1S/C16H11ClO2/c17-13-6-8-16(15(18)10-13)19-14-7-5-11-3-1-2-4-12(11)9-14/h1-10,18H
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n/an/a 41n/an/an/an/an/an/a



University of Illinois at Chicago

Curated by ChEMBL


Assay Description
Inhibition of Toxoplasma gondii enoyl reductase assessed as conversion of trans-2-acyl-ACP to acyl-ACP


Citation and Details
More data for this
Ligand-Target Pair
Enoyl-acyl carrier reductase


(Toxoplasma gondii)
BDBM119868
PNG
(2‐{4‐[(4‐butyl‐1,2,3‐...)
Show SMILES CCCCc1cn(Cc2ccc(Oc3ccc(Cl)cc3O)c(Cl)c2)nn1
Show InChI InChI=1S/C19H19Cl2N3O2/c1-2-3-4-15-12-24(23-22-15)11-13-5-7-18(16(21)9-13)26-19-8-6-14(20)10-17(19)25/h5-10,12,25H,2-4,11H2,1H3
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n/an/a 43n/an/an/an/an/an/a



Johns Hopkins Bloomberg School of Public Health



Assay Description
The reaction mixture (100 µL) contained 100 µM crotonyl-CoA, 1 µL DMSO (or compounds dissolved in DMSO), 5 nM TgENR, 100 mM sodium/pot...


Citation and Details
More data for this
Ligand-Target Pair
Enoyl-acyl carrier reductase


(Toxoplasma gondii)
BDBM50431920
PNG
(5‐(4‐chloro‐2‐hydroxypheno...)
Show SMILES Cc1cc(NC(=O)c2ccc(Oc3ccc(Cl)cc3O)o2)no1
Show InChI InChI=1S/C15H11ClN2O5/c1-8-6-13(18-23-8)17-15(20)12-4-5-14(22-12)21-11-3-2-9(16)7-10(11)19/h2-7,19H,1H3,(H,17,18,20)
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n/an/a 58n/an/an/an/an/an/a



University of Illinois at Chicago

Curated by ChEMBL


Assay Description
Inhibition of Toxoplasma gondii enoyl reductase assessed as conversion of trans-2-acyl-ACP to acyl-ACP


Citation and Details
More data for this
Ligand-Target Pair
Enoyl-acyl carrier reductase


(Toxoplasma gondii)
BDBM50431920
PNG
(5‐(4‐chloro‐2‐hydroxypheno...)
Show SMILES Cc1cc(NC(=O)c2ccc(Oc3ccc(Cl)cc3O)o2)no1
Show InChI InChI=1S/C15H11ClN2O5/c1-8-6-13(18-23-8)17-15(20)12-4-5-14(22-12)21-11-3-2-9(16)7-10(11)19/h2-7,19H,1H3,(H,17,18,20)
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n/an/a 58n/an/an/an/an/an/a



Johns Hopkins Bloomberg School of Public Health



Assay Description
The reaction mixture (100 µL) contained 100 µM crotonyl-CoA, 1 µL DMSO (or compounds dissolved in DMSO), 5 nM TgENR, 100 mM sodium/pot...


Citation and Details
More data for this
Ligand-Target Pair
Enoyl-acyl carrier reductase


(Toxoplasma gondii)
BDBM119871
PNG
(N‐{[3‐chloro‐4‐(4‐ch...)
Show SMILES Cc1cc(no1)C(=O)NCc1ccc(Oc2ccc(Cl)cc2O)c(Cl)c1
Show InChI InChI=1S/C18H14Cl2N2O4/c1-10-6-14(22-26-10)18(24)21-9-11-2-4-16(13(20)7-11)25-17-5-3-12(19)8-15(17)23/h2-8,23H,9H2,1H3,(H,21,24)
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n/an/a 100n/an/an/an/an/an/a



Johns Hopkins Bloomberg School of Public Health



Assay Description
The reaction mixture (100 µL) contained 100 µM crotonyl-CoA, 1 µL DMSO (or compounds dissolved in DMSO), 5 nM TgENR, 100 mM sodium/pot...


Citation and Details
More data for this
Ligand-Target Pair
Enoyl-acyl carrier reductase


(Toxoplasma gondii)
BDBM50326333
PNG
(5-chloro-2-(4-nitrophenoxy)phenol | CHEMBL1240784)
Show SMILES Oc1cc(Cl)ccc1Oc1ccc(cc1)[N+]([O-])=O
Show InChI InChI=1S/C12H8ClNO4/c13-8-1-6-12(11(15)7-8)18-10-4-2-9(3-5-10)14(16)17/h1-7,15H
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n/an/a 130n/an/an/an/an/an/a



University of Illinois at Chicago

Curated by ChEMBL


Assay Description
Inhibition of Toxoplasma gondii enoyl reductase


Citation and Details
More data for this
Ligand-Target Pair
Enoyl-acyl carrier reductase


(Toxoplasma gondii)
BDBM50431918
PNG
(CHEMBL2347828)
Show SMILES Oc1cc(Cl)ccc1Oc1ccc2ncccc2c1
Show InChI InChI=1S/C15H10ClNO2/c16-11-3-6-15(14(18)9-11)19-12-4-5-13-10(8-12)2-1-7-17-13/h1-9,18H
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n/an/a 135n/an/an/an/an/an/a



University of Illinois at Chicago

Curated by ChEMBL


Assay Description
Inhibition of Toxoplasma gondii enoyl reductase assessed as conversion of trans-2-acyl-ACP to acyl-ACP


Citation and Details
More data for this
Ligand-Target Pair
Enoyl-acyl carrier reductase


(Toxoplasma gondii)
BDBM50435718
PNG
(CHEMBL2392449)
Show SMILES CCCc1cc(no1)-c1ccc(Oc2ccc(CNC(=O)c3cc(C)on3)cc2O)c(Cl)c1
Show InChI InChI=1S/C24H22ClN3O5/c1-3-4-17-12-19(27-33-17)16-6-8-22(18(25)11-16)31-23-7-5-15(10-21(23)29)13-26-24(30)20-9-14(2)32-28-20/h5-12,29H,3-4,13H2,1-2H3,(H,26,30)
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n/an/a 137n/an/an/an/an/an/a



University of Leeds

Curated by ChEMBL


Assay Description
Inhibition of Toxoplasma gondii enoyl acyl-carrier protein reductase


Citation and Details
More data for this
Ligand-Target Pair
Enoyl-acyl carrier reductase


(Toxoplasma gondii)
BDBM50326320
PNG
(3-(2-Hydroxy-4-propylphenoxy)phenyl Boronic Acid |...)
Show SMILES CCCc1ccc(Oc2cccc(c2)B(O)O)c(O)c1
Show InChI InChI=1S/C15H17BO4/c1-2-4-11-7-8-15(14(17)9-11)20-13-6-3-5-12(10-13)16(18)19/h3,5-10,17-19H,2,4H2,1H3
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n/an/a 174n/an/an/an/an/an/a



University of Illinois at Chicago

Curated by ChEMBL


Assay Description
Inhibition of Toxoplasma gondii enoyl reductase


Citation and Details
More data for this
Ligand-Target Pair
Enoyl-acyl carrier reductase


(Toxoplasma gondii)
BDBM50431921
PNG
(CHEMBL2347842)
Show SMILES CC(=O)N1CCN(CC1)c1ccc(Oc2ccc(Cl)cc2O)cc1
Show InChI InChI=1S/C18H19ClN2O3/c1-13(22)20-8-10-21(11-9-20)15-3-5-16(6-4-15)24-18-7-2-14(19)12-17(18)23/h2-7,12,23H,8-11H2,1H3
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n/an/a 225n/an/an/an/an/an/a



University of Illinois at Chicago

Curated by ChEMBL


Assay Description
Inhibition of Toxoplasma gondii enoyl reductase assessed as conversion of trans-2-acyl-ACP to acyl-ACP


Citation and Details
More data for this
Ligand-Target Pair
Enoyl-acyl carrier reductase


(Toxoplasma gondii)
BDBM50326323
PNG
(4-(2,6-Dihydroxy-4-propylphenoxy)benzamide | CHEMB...)
Show SMILES CCCc1cc(O)c(Oc2ccc(cc2)C(N)=O)c(O)c1
Show InChI InChI=1S/C16H17NO4/c1-2-3-10-8-13(18)15(14(19)9-10)21-12-6-4-11(5-7-12)16(17)20/h4-9,18-19H,2-3H2,1H3,(H2,17,20)
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n/an/a 280n/an/an/an/an/an/a



University of Illinois at Chicago

Curated by ChEMBL


Assay Description
Inhibition of Toxoplasma gondii enoyl reductase


Citation and Details
More data for this
Ligand-Target Pair
Enoyl-acyl carrier reductase


(Toxoplasma gondii)
BDBM50326334
PNG
(5-chloro-2-(2-nitrophenoxy)phenol | CHEMBL1240785)
Show SMILES Oc1cc(Cl)ccc1Oc1ccccc1[N+]([O-])=O
Show InChI InChI=1S/C12H8ClNO4/c13-8-5-6-12(10(15)7-8)18-11-4-2-1-3-9(11)14(16)17/h1-7,15H
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n/an/a 290n/an/an/an/an/an/a



University of Illinois at Chicago

Curated by ChEMBL


Assay Description
Inhibition of Toxoplasma gondii enoyl reductase


Citation and Details
More data for this
Ligand-Target Pair
Enoyl-acyl carrier reductase


(Toxoplasma gondii)
BDBM50326331
PNG
(2-(biphenyl-4-yloxy)-5-chlorophenol | CHEMBL124302...)
Show SMILES Oc1cc(Cl)ccc1Oc1ccc(cc1)-c1ccccc1
Show InChI InChI=1S/C18H13ClO2/c19-15-8-11-18(17(20)12-15)21-16-9-6-14(7-10-16)13-4-2-1-3-5-13/h1-12,20H
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n/an/a 490n/an/an/an/an/an/a



University of Illinois at Chicago

Curated by ChEMBL


Assay Description
Inhibition of Toxoplasma gondii enoyl reductase


Citation and Details
More data for this
Ligand-Target Pair
Enoyl-acyl carrier reductase


(Toxoplasma gondii)
BDBM50431919
PNG
(CHEMBL2347830)
Show SMILES CC(=O)N1CCN(Cc2ccc(Oc3ccc(Cl)cc3O)s2)CC1
Show InChI InChI=1S/C17H19ClN2O3S/c1-12(21)20-8-6-19(7-9-20)11-14-3-5-17(24-14)23-16-4-2-13(18)10-15(16)22/h2-5,10,22H,6-9,11H2,1H3
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n/an/a 965n/an/an/an/an/an/a



University of Illinois at Chicago

Curated by ChEMBL


Assay Description
Inhibition of Toxoplasma gondii enoyl reductase assessed as conversion of trans-2-acyl-ACP to acyl-ACP


Citation and Details
More data for this
Ligand-Target Pair
Enoyl-acyl carrier reductase


(Toxoplasma gondii)
BDBM50447261
PNG
(CHEMBL1945694)
Show SMILES Cc1cc2ncn(Cc3ccc(Cl)cc3)c2cc1C
Show InChI InChI=1S/C16H15ClN2/c1-11-7-15-16(8-12(11)2)19(10-18-15)9-13-3-5-14(17)6-4-13/h3-8,10H,9H2,1-2H3
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n/an/a>1.00E+3n/an/an/an/an/an/a



University of Leeds

Curated by ChEMBL


Assay Description
Inhibition of Toxoplasma gondii enoyl-ACP reductase-NADH complex


Citation and Details
More data for this
Ligand-Target Pair
Enoyl-acyl carrier reductase


(Toxoplasma gondii)
BDBM50447260
PNG
(CHEMBL2270735)
Show SMILES Cc1ccc(Cn2cnc3cc(C)c(C)cc23)cc1
Show InChI InChI=1S/C17H18N2/c1-12-4-6-15(7-5-12)10-19-11-18-16-8-13(2)14(3)9-17(16)19/h4-9,11H,10H2,1-3H3
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University of Leeds

Curated by ChEMBL


Assay Description
Inhibition of Toxoplasma gondii enoyl-ACP reductase-NADH complex


Citation and Details
More data for this
Ligand-Target Pair
Enoyl-acyl carrier reductase


(Toxoplasma gondii)
BDBM50392117
PNG
(CHEMBL1945507)
Show SMILES Cc1cc2ncn(Cc3ccc(Cl)c(Cl)c3)c2cc1C
Show InChI InChI=1S/C16H14Cl2N2/c1-10-5-15-16(6-11(10)2)20(9-19-15)8-12-3-4-13(17)14(18)7-12/h3-7,9H,8H2,1-2H3
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University of Leeds

Curated by ChEMBL


Assay Description
Inhibition of Toxoplasma gondii enoyl-ACP reductase-NADH complex


Citation and Details
More data for this
Ligand-Target Pair
Enoyl-acyl carrier reductase


(Toxoplasma gondii)
BDBM50326322
PNG
(CHEMBL1243120 | Hexa-2,4-dienoic Acid(4-(2,4-Dichl...)
Show SMILES C\C=C\C=C\C(=O)Nc1ccc(Oc2ccc(Cl)cc2Cl)c(O)c1
Show InChI InChI=1S/C18H15Cl2NO3/c1-2-3-4-5-18(23)21-13-7-9-17(15(22)11-13)24-16-8-6-12(19)10-14(16)20/h2-11,22H,1H3,(H,21,23)/b3-2+,5-4+
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n/an/a 2.00E+3n/an/an/an/an/an/a



University of Illinois at Chicago

Curated by ChEMBL


Assay Description
Inhibition of Toxoplasma gondii enoyl reductase


Citation and Details
More data for this
Ligand-Target Pair
Enoyl-acyl carrier reductase


(Toxoplasma gondii)
BDBM50326321
PNG
(CHEMBL1243085 | Hexa-2,4-dienoic Acid(4-(4-Chloro-...)
Show SMILES C\C=C\C=C\C(=O)Nc1ccc(Oc2ccc(Cl)cc2O)cc1
Show InChI InChI=1S/C18H16ClNO3/c1-2-3-4-5-18(22)20-14-7-9-15(10-8-14)23-17-11-6-13(19)12-16(17)21/h2-12,21H,1H3,(H,20,22)/b3-2+,5-4+
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University of Illinois at Chicago

Curated by ChEMBL


Assay Description
Inhibition of Toxoplasma gondii enoyl reductase


Citation and Details
More data for this
Ligand-Target Pair
Enoyl-acyl carrier reductase


(Toxoplasma gondii)
BDBM50326324
PNG
(1-(2-chlorobenzyl)-4-(3-(9H-carbazol-9-yl)propoxy)...)
Show SMILES Clc1ccccc1Cn1ccc(OCCCn2c3ccccc3c3ccccc23)cc1=O
Show InChI InChI=1S/C27H23ClN2O2/c28-24-11-4-1-8-20(24)19-29-16-14-21(18-27(29)31)32-17-7-15-30-25-12-5-2-9-22(25)23-10-3-6-13-26(23)30/h1-6,8-14,16,18H,7,15,17,19H2
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University of Illinois at Chicago

Curated by ChEMBL


Assay Description
Inhibition of Toxoplasma gondii enoyl reductase


Citation and Details
More data for this
Ligand-Target Pair
Enoyl-acyl carrier reductase


(Toxoplasma gondii)
BDBM50326319
PNG
(5-chloro-2-(pyridin-3-yloxy)phenol | CHEMBL1240915)
Show SMILES Oc1cc(Cl)ccc1Oc1cccnc1
Show InChI InChI=1S/C11H8ClNO2/c12-8-3-4-11(10(14)6-8)15-9-2-1-5-13-7-9/h1-7,14H
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n/an/a 2.80E+3n/an/an/an/an/an/a



University of Illinois at Chicago

Curated by ChEMBL


Assay Description
Inhibition of Toxoplasma gondii enoyl reductase


Citation and Details
More data for this
Ligand-Target Pair
Enoyl-acyl carrier reductase


(Toxoplasma gondii)
BDBM50326329
PNG
(5-Chloro-2-(2,4-dichlorophenoxy)phenyl Pivaloate |...)
Show SMILES CC(C)(C)C(=O)Oc1cc(Cl)ccc1Oc1ccc(Cl)cc1Cl
Show InChI InChI=1S/C17H15Cl3O3/c1-17(2,3)16(21)23-15-9-11(19)5-7-14(15)22-13-6-4-10(18)8-12(13)20/h4-9H,1-3H3
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n/an/a 3.00E+3n/an/an/an/an/an/a



University of Illinois at Chicago

Curated by ChEMBL


Assay Description
Inhibition of Toxoplasma gondii enoyl reductase


Citation and Details
More data for this
Ligand-Target Pair
Enoyl-acyl carrier reductase


(Toxoplasma gondii)
BDBM50326328
PNG
(4-((4-(benzyloxy)-2-oxopyridin-1(2H)-yl)methyl)-3-...)
Show SMILES Clc1cc(ccc1Cn1ccc(OCc2ccccc2)cc1=O)C#N
Show InChI InChI=1S/C20H15ClN2O2/c21-19-10-16(12-22)6-7-17(19)13-23-9-8-18(11-20(23)24)25-14-15-4-2-1-3-5-15/h1-11H,13-14H2
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University of Illinois at Chicago

Curated by ChEMBL


Assay Description
Inhibition of Toxoplasma gondii enoyl reductase


Citation and Details
More data for this
Ligand-Target Pair
Enoyl-acyl carrier reductase


(Toxoplasma gondii)
BDBM50326325
PNG
(1-(2-chloro-4-nitrobenzyl)-4-(benzyloxy)pyridin-2(...)
Show SMILES [O-][N+](=O)c1ccc(Cn2ccc(OCc3ccccc3)cc2=O)c(Cl)c1
Show InChI InChI=1S/C19H15ClN2O4/c20-18-10-16(22(24)25)7-6-15(18)12-21-9-8-17(11-19(21)23)26-13-14-4-2-1-3-5-14/h1-11H,12-13H2
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University of Illinois at Chicago

Curated by ChEMBL


Assay Description
Inhibition of Toxoplasma gondii enoyl reductase


Citation and Details
More data for this
Ligand-Target Pair
Enoyl-acyl carrier reductase


(Toxoplasma gondii)
BDBM50326330
PNG
(5-chloro-2-phenoxyaniline | CHEMBL1240673)
Show SMILES Nc1cc(Cl)ccc1Oc1ccccc1
Show InChI InChI=1S/C12H10ClNO/c13-9-6-7-12(11(14)8-9)15-10-4-2-1-3-5-10/h1-8H,14H2
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University of Illinois at Chicago

Curated by ChEMBL


Assay Description
Inhibition of Toxoplasma gondii enoyl reductase


Citation and Details
More data for this
Ligand-Target Pair
Enoyl-acyl carrier reductase


(Toxoplasma gondii)
BDBM50326326
PNG
(1-(2-chlorobenzyl)-4-(benzyloxy)pyridin-2(1H)-one ...)
Show SMILES Clc1ccccc1Cn1ccc(OCc2ccccc2)cc1=O
Show InChI InChI=1S/C19H16ClNO2/c20-18-9-5-4-8-16(18)13-21-11-10-17(12-19(21)22)23-14-15-6-2-1-3-7-15/h1-12H,13-14H2
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University of Illinois at Chicago

Curated by ChEMBL


Assay Description
Inhibition of Toxoplasma gondii enoyl reductase


Citation and Details
More data for this
Ligand-Target Pair
Enoyl-acyl carrier reductase


(Toxoplasma gondii)
BDBM50326332
PNG
(2-Amino-N-(5-chloro-2-phenoxyphenyl)nicotinamide |...)
Show SMILES Nc1ncccc1C(=O)Nc1cc(Cl)ccc1Oc1ccccc1
Show InChI InChI=1S/C18H14ClN3O2/c19-12-8-9-16(24-13-5-2-1-3-6-13)15(11-12)22-18(23)14-7-4-10-21-17(14)20/h1-11H,(H2,20,21)(H,22,23)
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University of Illinois at Chicago

Curated by ChEMBL


Assay Description
Inhibition of Toxoplasma gondii enoyl reductase


Citation and Details
More data for this
Ligand-Target Pair
Enoyl-acyl carrier reductase


(Toxoplasma gondii)
BDBM50326327
PNG
(1-(2-chlorobenzyl)-4-(4-methoxybenzyloxy)pyridin-2...)
Show SMILES COc1ccc(COc2ccn(Cc3ccccc3Cl)c(=O)c2)cc1
Show InChI InChI=1S/C20H18ClNO3/c1-24-17-8-6-15(7-9-17)14-25-18-10-11-22(20(23)12-18)13-16-4-2-3-5-19(16)21/h2-12H,13-14H2,1H3
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University of Illinois at Chicago

Curated by ChEMBL


Assay Description
Inhibition of Toxoplasma gondii enoyl reductase


Citation and Details
More data for this
Ligand-Target Pair