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Compile Data Set for Download or QSAR

Found 61 hits of ki data for polymerid = 50002734,50006542   
Target/Host
(Institution)
LigandTarget/Host
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
Acetolactate synthase


(Arabidopsis thaliana)
BDBM50487040
PNG
(PYRIMINOBAC-METHYL)
Show SMILES CO\N=C(\C)c1cccc(Oc2nc(OC)cc(OC)n2)c1C(=O)OC
Show InChI InChI=1S/C17H19N3O6/c1-10(20-25-5)11-7-6-8-12(15(11)16(21)24-4)26-17-18-13(22-2)9-14(19-17)23-3/h6-9H,1-5H3/b20-10-
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0.490n/an/an/an/an/an/an/an/a



Central China Normal University

Curated by ChEMBL


Assay Description
Inhibition of wild type Arabidopsis thaliana acetohydroxyacid synthase


J Agric Food Chem 54: 9135-9 (2006)

More data for this
Ligand-Target Pair
Acetolactate synthase


(Arabidopsis thaliana)
BDBM50487044
PNG
(CHEMBL2253248)
Show SMILES COc1cc(OC)nc(Oc2cccc3c(C)nn(Cc4ccc(Cl)cc4)c(=O)c23)n1
Show InChI InChI=1S/C22H19ClN4O4/c1-13-16-5-4-6-17(31-22-24-18(29-2)11-19(25-22)30-3)20(16)21(28)27(26-13)12-14-7-9-15(23)10-8-14/h4-11H,12H2,1-3H3
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2n/an/an/an/an/an/an/an/a



Central China Normal University

Curated by ChEMBL


Assay Description
Inhibition of wild type Arabidopsis thaliana acetohydroxyacid synthase


J Agric Food Chem 54: 9135-9 (2006)

More data for this
Ligand-Target Pair
Acetolactate synthase


(Arabidopsis thaliana)
BDBM50487043
PNG
(CHEMBL2253250)
Show SMILES COc1cc(OC)nc(Oc2cccc3c(C)nn(Cc4ccccc4Cl)c(=O)c23)n1
Show InChI InChI=1S/C22H19ClN4O4/c1-13-15-8-6-10-17(31-22-24-18(29-2)11-19(25-22)30-3)20(15)21(28)27(26-13)12-14-7-4-5-9-16(14)23/h4-11H,12H2,1-3H3
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2.10n/an/an/an/an/an/an/an/a



Central China Normal University

Curated by ChEMBL


Assay Description
Inhibition of wild type Arabidopsis thaliana acetohydroxyacid synthase


J Agric Food Chem 54: 9135-9 (2006)

More data for this
Ligand-Target Pair
Acetolactate synthase


(Arabidopsis thaliana)
BDBM50487049
PNG
(CHEMBL2253251)
Show SMILES COc1cc(OC)nc(Oc2cccc3c(C)nn(Cc4cccc(Cl)c4)c(=O)c23)n1
Show InChI InChI=1S/C22H19ClN4O4/c1-13-16-8-5-9-17(31-22-24-18(29-2)11-19(25-22)30-3)20(16)21(28)27(26-13)12-14-6-4-7-15(23)10-14/h4-11H,12H2,1-3H3
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2.20n/an/an/an/an/an/an/an/a



Central China Normal University

Curated by ChEMBL


Assay Description
Inhibition of wild type Arabidopsis thaliana acetohydroxyacid synthase


J Agric Food Chem 54: 9135-9 (2006)

More data for this
Ligand-Target Pair
Acetolactate synthase


(Arabidopsis thaliana)
BDBM50487035
PNG
(CHEMBL2253252)
Show SMILES COc1cc(OC)nc(Oc2cccc3c(C)nn(Cc4ccccc4C)c(=O)c23)n1
Show InChI InChI=1S/C23H22N4O4/c1-14-8-5-6-9-16(14)13-27-22(28)21-17(15(2)26-27)10-7-11-18(21)31-23-24-19(29-3)12-20(25-23)30-4/h5-12H,13H2,1-4H3
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2.60n/an/an/an/an/an/an/an/a



Central China Normal University

Curated by ChEMBL


Assay Description
Inhibition of wild type Arabidopsis thaliana acetohydroxyacid synthase


J Agric Food Chem 54: 9135-9 (2006)

More data for this
Ligand-Target Pair
Acetolactate synthase


(Arabidopsis thaliana)
BDBM50487050
PNG
(CHEMBL2253246)
Show SMILES COc1cc(OC)nc(Oc2cccc3c(C)nn(Cc4ccc(Br)cc4)c(=O)c23)n1
Show InChI InChI=1S/C22H19BrN4O4/c1-13-16-5-4-6-17(31-22-24-18(29-2)11-19(25-22)30-3)20(16)21(28)27(26-13)12-14-7-9-15(23)10-8-14/h4-11H,12H2,1-3H3
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3.10n/an/an/an/an/an/an/an/a



Central China Normal University

Curated by ChEMBL


Assay Description
Inhibition of wild type Arabidopsis thaliana acetohydroxyacid synthase


J Agric Food Chem 54: 9135-9 (2006)

More data for this
Ligand-Target Pair
Acetolactate synthase


(Arabidopsis thaliana)
BDBM50487038
PNG
(CHEMBL2253249)
Show SMILES COc1cc(OC)nc(Oc2cccc3c(C)nn(Cc4cc(C)ccc4[N+]([O-])=O)c(=O)c23)n1
Show InChI InChI=1S/C23H21N5O6/c1-13-8-9-17(28(30)31)15(10-13)12-27-22(29)21-16(14(2)26-27)6-5-7-18(21)34-23-24-19(32-3)11-20(25-23)33-4/h5-11H,12H2,1-4H3
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3.10n/an/an/an/an/an/an/an/a



Central China Normal University

Curated by ChEMBL


Assay Description
Inhibition of wild type Arabidopsis thaliana acetohydroxyacid synthase


J Agric Food Chem 54: 9135-9 (2006)

More data for this
Ligand-Target Pair
Acetolactate synthase


(Arabidopsis thaliana)
BDBM50487047
PNG
(CHEMBL2253244)
Show SMILES COc1cc(OC)nc(Oc2cccc3c(C)nn(Cc4ccccc4Br)c(=O)c23)n1
Show InChI InChI=1S/C22H19BrN4O4/c1-13-15-8-6-10-17(31-22-24-18(29-2)11-19(25-22)30-3)20(15)21(28)27(26-13)12-14-7-4-5-9-16(14)23/h4-11H,12H2,1-3H3
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3.60n/an/an/an/an/an/an/an/a



Central China Normal University

Curated by ChEMBL


Assay Description
Inhibition of wild type Arabidopsis thaliana acetohydroxyacid synthase


J Agric Food Chem 54: 9135-9 (2006)

More data for this
Ligand-Target Pair
Acetolactate synthase


(Arabidopsis thaliana)
BDBM50487053
PNG
(CHEMBL2253240)
Show SMILES COc1cc(OC)nc(Oc2cccc3c(C)nn(Cc4ccc(Br)cc4F)c(=O)c23)n1
Show InChI InChI=1S/C22H18BrFN4O4/c1-12-15-5-4-6-17(32-22-25-18(30-2)10-19(26-22)31-3)20(15)21(29)28(27-12)11-13-7-8-14(23)9-16(13)24/h4-10H,11H2,1-3H3
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4.20n/an/an/an/an/an/an/an/a



Central China Normal University

Curated by ChEMBL


Assay Description
Inhibition of wild type Arabidopsis thaliana acetohydroxyacid synthase


J Agric Food Chem 54: 9135-9 (2006)

More data for this
Ligand-Target Pair
Acetolactate synthase


(Arabidopsis thaliana)
BDBM50487042
PNG
(CHEMBL2253253)
Show SMILES CCCCn1nc(C)c2cccc(Oc3nc(OC)cc(OC)n3)c2c1=O
Show InChI InChI=1S/C19H22N4O4/c1-5-6-10-23-18(24)17-13(12(2)22-23)8-7-9-14(17)27-19-20-15(25-3)11-16(21-19)26-4/h7-9,11H,5-6,10H2,1-4H3
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4.40n/an/an/an/an/an/an/an/a



Central China Normal University

Curated by ChEMBL


Assay Description
Inhibition of wild type Arabidopsis thaliana acetohydroxyacid synthase


J Agric Food Chem 54: 9135-9 (2006)

More data for this
Ligand-Target Pair
Acetolactate synthase


(Arabidopsis thaliana)
BDBM50487039
PNG
(CHEMBL2253256)
Show SMILES CCOC(=O)Cn1nc(C)c2cccc(Oc3nc(OC)cc(OC)n3)c2c1=O
Show InChI InChI=1S/C19H20N4O6/c1-5-28-16(24)10-23-18(25)17-12(11(2)22-23)7-6-8-13(17)29-19-20-14(26-3)9-15(21-19)27-4/h6-9H,5,10H2,1-4H3
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5.60n/an/an/an/an/an/an/an/a



Central China Normal University

Curated by ChEMBL


Assay Description
Inhibition of wild type Arabidopsis thaliana acetohydroxyacid synthase


J Agric Food Chem 54: 9135-9 (2006)

More data for this
Ligand-Target Pair
Acetolactate synthase


(Arabidopsis thaliana)
BDBM50487048
PNG
(CHEMBL2253241)
Show SMILES COc1cc(OC)nc(Oc2cccc3c(C)nn(Cc4c(F)cccc4F)c(=O)c23)n1
Show InChI InChI=1S/C22H18F2N4O4/c1-12-13-6-4-9-17(32-22-25-18(30-2)10-19(26-22)31-3)20(13)21(29)28(27-12)11-14-15(23)7-5-8-16(14)24/h4-10H,11H2,1-3H3
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6.30n/an/an/an/an/an/an/an/a



Central China Normal University

Curated by ChEMBL


Assay Description
Inhibition of wild type Arabidopsis thaliana acetohydroxyacid synthase


J Agric Food Chem 54: 9135-9 (2006)

More data for this
Ligand-Target Pair
Acetolactate synthase


(Arabidopsis thaliana)
BDBM50487045
PNG
(CHEMBL2253247)
Show SMILES COc1cc(OC)nc(Oc2cccc3c(C)nn(Cc4ccc(C)cc4)c(=O)c23)n1
Show InChI InChI=1S/C23H22N4O4/c1-14-8-10-16(11-9-14)13-27-22(28)21-17(15(2)26-27)6-5-7-18(21)31-23-24-19(29-3)12-20(25-23)30-4/h5-12H,13H2,1-4H3
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6.40n/an/an/an/an/an/an/an/a



Central China Normal University

Curated by ChEMBL


Assay Description
Inhibition of wild type Arabidopsis thaliana acetohydroxyacid synthase


J Agric Food Chem 54: 9135-9 (2006)

More data for this
Ligand-Target Pair
Acetolactate synthase


(Arabidopsis thaliana)
BDBM50487037
PNG
(CHEMBL2253234)
Show SMILES CCc1ccc(cc1)C(=O)n1nc(C)c2cccc(Oc3nc(OC)cc(OC)n3)c2c1=O
Show InChI InChI=1S/C24H22N4O5/c1-5-15-9-11-16(12-10-15)22(29)28-23(30)21-17(14(2)27-28)7-6-8-18(21)33-24-25-19(31-3)13-20(26-24)32-4/h6-13H,5H2,1-4H3
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7.10n/an/an/an/an/an/an/an/a



Central China Normal University

Curated by ChEMBL


Assay Description
Inhibition of wild type Arabidopsis thaliana acetohydroxyacid synthase


J Agric Food Chem 54: 9135-9 (2006)

More data for this
Ligand-Target Pair
Acetolactate synthase


(Arabidopsis thaliana)
BDBM50487046
PNG
(CHEMBL2253245)
Show SMILES COc1cc(OC)nc(Oc2cccc3c(C)nn(Cc4cccc(Br)c4)c(=O)c23)n1
Show InChI InChI=1S/C22H19BrN4O4/c1-13-16-8-5-9-17(31-22-24-18(29-2)11-19(25-22)30-3)20(16)21(28)27(26-13)12-14-6-4-7-15(23)10-14/h4-11H,12H2,1-3H3
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7.60n/an/an/an/an/an/an/an/a



Central China Normal University

Curated by ChEMBL


Assay Description
Inhibition of wild type Arabidopsis thaliana acetohydroxyacid synthase


J Agric Food Chem 54: 9135-9 (2006)

More data for this
Ligand-Target Pair
Acetolactate synthase


(Arabidopsis thaliana)
BDBM50487052
PNG
(CHEMBL2253236)
Show SMILES COc1cc(OC)nc(Oc2cccc3c(C)nn(CC4OCCO4)c(=O)c23)n1
Show InChI InChI=1S/C19H20N4O6/c1-11-12-5-4-6-13(29-19-20-14(25-2)9-15(21-19)26-3)17(12)18(24)23(22-11)10-16-27-7-8-28-16/h4-6,9,16H,7-8,10H2,1-3H3
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7.80n/an/an/an/an/an/an/an/a



Central China Normal University

Curated by ChEMBL


Assay Description
Inhibition of wild type Arabidopsis thaliana acetohydroxyacid synthase


J Agric Food Chem 54: 9135-9 (2006)

More data for this
Ligand-Target Pair
Acetolactate synthase


(Arabidopsis thaliana)
BDBM50487034
PNG
(CHEMBL2253254)
Show SMILES COc1cc(OC)nc(Oc2cccc3c(C)n[nH]c(=O)c23)n1
Show InChI InChI=1S/C15H14N4O4/c1-8-9-5-4-6-10(13(9)14(20)19-18-8)23-15-16-11(21-2)7-12(17-15)22-3/h4-7H,1-3H3,(H,19,20)
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7.90n/an/an/an/an/an/an/an/a



Central China Normal University

Curated by ChEMBL


Assay Description
Inhibition of wild type Arabidopsis thaliana acetohydroxyacid synthase


J Agric Food Chem 54: 9135-9 (2006)

More data for this
Ligand-Target Pair
Acetolactate synthase


(Arabidopsis thaliana)
BDBM50424585
PNG
(CHEMBL1231791 | Chlorimuron Ethyl)
Show SMILES CCOC(=O)c1ccccc1S(=O)(=O)NC(=O)Nc1nc(Cl)cc(OC)n1
Show InChI InChI=1S/C15H15ClN4O6S/c1-3-26-13(21)9-6-4-5-7-10(9)27(23,24)20-15(22)19-14-17-11(16)8-12(18-14)25-2/h4-8H,3H2,1-2H3,(H2,17,18,19,20,22)
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8n/an/an/an/an/an/an/an/a



The University of Queensland

Curated by ChEMBL


Assay Description
Inhibition of Arabidopsis thaliana acetohydroxyacid synthase


J Med Chem 56: 210-9 (2013)


Article DOI: 10.1021/jm301501k
BindingDB Entry DOI: 10.7270/Q22Z16TH
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Acetolactate synthase


(Arabidopsis thaliana)
BDBM50487054
PNG
(CHEMBL2253239)
Show SMILES COc1cc(OC)nc(Oc2cccc3c(C)nn(Cc4ccccc4)c(=O)c23)n1
Show InChI InChI=1S/C22H20N4O4/c1-14-16-10-7-11-17(30-22-23-18(28-2)12-19(24-22)29-3)20(16)21(27)26(25-14)13-15-8-5-4-6-9-15/h4-12H,13H2,1-3H3
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8.20n/an/an/an/an/an/an/an/a



Central China Normal University

Curated by ChEMBL


Assay Description
Inhibition of wild type Arabidopsis thaliana acetohydroxyacid synthase


J Agric Food Chem 54: 9135-9 (2006)

More data for this
Ligand-Target Pair
Acetolactate synthase


(Arabidopsis thaliana)
BDBM50487057
PNG
(CHEMBL2253242)
Show SMILES COc1cc(OC)nc(Oc2cccc3c(C)nn(Cc4ccc(F)cc4F)c(=O)c23)n1
Show InChI InChI=1S/C22H18F2N4O4/c1-12-15-5-4-6-17(32-22-25-18(30-2)10-19(26-22)31-3)20(15)21(29)28(27-12)11-13-7-8-14(23)9-16(13)24/h4-10H,11H2,1-3H3
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10n/an/an/an/an/an/an/an/a



Central China Normal University

Curated by ChEMBL


Assay Description
Inhibition of wild type Arabidopsis thaliana acetohydroxyacid synthase


J Agric Food Chem 54: 9135-9 (2006)

More data for this
Ligand-Target Pair
Acetolactate synthase


(Arabidopsis thaliana)
BDBM50424585
PNG
(CHEMBL1231791 | Chlorimuron Ethyl)
Show SMILES CCOC(=O)c1ccccc1S(=O)(=O)NC(=O)Nc1nc(Cl)cc(OC)n1
Show InChI InChI=1S/C15H15ClN4O6S/c1-3-26-13(21)9-6-4-5-7-10(9)27(23,24)20-15(22)19-14-17-11(16)8-12(18-14)25-2/h4-8H,3H2,1-2H3,(H2,17,18,19,20,22)
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11n/an/an/an/an/an/an/an/a



University of Queensland

Curated by ChEMBL


Assay Description
Inhibition of Arabidopsis thaliana AHAS expressed in Escherichia coli strain BL21 (DE3) by colorimetric assay


Proc Natl Acad Sci USA 103: 569-73 (2006)

More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Acetolactate synthase


(Arabidopsis thaliana)
BDBM50487036
PNG
(CHEMBL2253243)
Show SMILES COc1cc(OC)nc(Oc2cccc3c(C)nn(Cc4cccc(F)c4)c(=O)c23)n1
Show InChI InChI=1S/C22H19FN4O4/c1-13-16-8-5-9-17(31-22-24-18(29-2)11-19(25-22)30-3)20(16)21(28)27(26-13)12-14-6-4-7-15(23)10-14/h4-11H,12H2,1-3H3
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14n/an/an/an/an/an/an/an/a



Central China Normal University

Curated by ChEMBL


Assay Description
Inhibition of wild type Arabidopsis thaliana acetohydroxyacid synthase


J Agric Food Chem 54: 9135-9 (2006)

More data for this
Ligand-Target Pair
Acetolactate synthase


(Arabidopsis thaliana)
BDBM50487055
PNG
(CHEMBL2253235)
Show SMILES COc1cc(OC)nc(Oc2cccc3c(C)nn(CC(=O)OC(C)(C)C)c(=O)c23)n1
Show InChI InChI=1S/C21H24N4O6/c1-12-13-8-7-9-14(30-20-22-15(28-5)10-16(23-20)29-6)18(13)19(27)25(24-12)11-17(26)31-21(2,3)4/h7-10H,11H2,1-6H3
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16n/an/an/an/an/an/an/an/a



Central China Normal University

Curated by ChEMBL


Assay Description
Inhibition of wild type Arabidopsis thaliana acetohydroxyacid synthase


J Agric Food Chem 54: 9135-9 (2006)

More data for this
Ligand-Target Pair
Acetolactate synthase


(Arabidopsis thaliana)
BDBM50487051
PNG
(CHEMBL2253238)
Show SMILES CCn1nc(C)c2cccc(Oc3nc(OC)cc(OC)n3)c2c1=O
Show InChI InChI=1S/C17H18N4O4/c1-5-21-16(22)15-11(10(2)20-21)7-6-8-12(15)25-17-18-13(23-3)9-14(19-17)24-4/h6-9H,5H2,1-4H3
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17n/an/an/an/an/an/an/an/a



Central China Normal University

Curated by ChEMBL


Assay Description
Inhibition of wild type Arabidopsis thaliana acetohydroxyacid synthase


J Agric Food Chem 54: 9135-9 (2006)

More data for this
Ligand-Target Pair
Acetolactate synthase


(Arabidopsis thaliana)
BDBM50487041
PNG
(CHEMBL2253233)
Show SMILES CCCn1nc(C)c2cccc(Oc3nc(OC)cc(OC)n3)c2c1=O
Show InChI InChI=1S/C18H20N4O4/c1-5-9-22-17(23)16-12(11(2)21-22)7-6-8-13(16)26-18-19-14(24-3)10-15(20-18)25-4/h6-8,10H,5,9H2,1-4H3
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17n/an/an/an/an/an/an/an/a



Central China Normal University

Curated by ChEMBL


Assay Description
Inhibition of wild type Arabidopsis thaliana acetohydroxyacid synthase


J Agric Food Chem 54: 9135-9 (2006)

More data for this
Ligand-Target Pair
Acetolactate synthase


(Arabidopsis thaliana)
BDBM50487056
PNG
(CHEMBL2253255)
Show SMILES COc1cc(OC)nc(Oc2cccc3c(C)nn(C4CC4)c(=O)c23)n1
Show InChI InChI=1S/C18H18N4O4/c1-10-12-5-4-6-13(16(12)17(23)22(21-10)11-7-8-11)26-18-19-14(24-2)9-15(20-18)25-3/h4-6,9,11H,7-8H2,1-3H3
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53n/an/an/an/an/an/an/an/a



Central China Normal University

Curated by ChEMBL


Assay Description
Inhibition of wild type Arabidopsis thaliana acetohydroxyacid synthase


J Agric Food Chem 54: 9135-9 (2006)

More data for this
Ligand-Target Pair
Acetolactate synthase


(Arabidopsis thaliana)
BDBM50424586
PNG
(CHEMBL1229780 | Tribenuron Methyl)
Show SMILES COC(=O)c1ccccc1S(=O)(=O)NC(=O)N(C)c1nc(C)nc(OC)n1
Show InChI InChI=1S/C15H17N5O6S/c1-9-16-13(18-14(17-9)26-4)20(2)15(22)19-27(23,24)11-8-6-5-7-10(11)12(21)25-3/h5-8H,1-4H3,(H,19,22)
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253n/an/an/an/an/an/an/an/a



University of Queensland

Curated by ChEMBL


Assay Description
Inhibition of Arabidopsis thaliana AHAS expressed in Escherichia coli strain BL21 (DE3) by colorimetric assay


Proc Natl Acad Sci USA 103: 569-73 (2006)

More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Acetolactate synthase


(Arabidopsis thaliana)
BDBM50486243
PNG
(MONOSULFURON ESTER)
Show SMILES COC(=O)c1ccccc1S(=O)(=O)NC(=O)Nc1nccc(C)n1
Show InChI InChI=1S/C14H14N4O5S/c1-9-7-8-15-13(16-9)17-14(20)18-24(21,22)11-6-4-3-5-10(11)12(19)23-2/h3-8H,1-2H3,(H2,15,16,17,18,20)
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260n/an/an/an/an/an/an/an/a



Nankai University

Curated by ChEMBL


Assay Description
Inhibition of wild type Arabidopsis thaliana acetohydroxyacid synthase colorimetric assay


J Agric Food Chem 60: 8286-93 (2012)

More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Acetolactate synthase


(Arabidopsis thaliana)
BDBM50004708
PNG
(FLUMETSULAM)
Show SMILES Cc1ccn2nc(nc2n1)S(=O)(=O)Nc1c(F)cccc1F
Show InChI InChI=1S/C12H9F2N5O2S/c1-7-5-6-19-11(15-7)16-12(17-19)22(20,21)18-10-8(13)3-2-4-9(10)14/h2-6,18H,1H3
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360n/an/an/an/an/an/an/an/a



Central China Normal University

Curated by ChEMBL


Assay Description
Inhibition of wild type Arabidopsis thaliana acetolactate synthase by colorimetry


Bioorg Med Chem 18: 4897-904 (2010)

More data for this
Ligand-Target Pair
Acetolactate synthase


(Arabidopsis thaliana)
BDBM50487171
PNG
(CHEMBL2251948)
Show SMILES COC(=O)c1cccc(Cl)c1NS(=O)(=O)c1nc2c(Cl)c(C)nc(C)n2n1
Show InChI InChI=1S/C15H13Cl2N5O4S/c1-7-11(17)13-19-15(20-22(13)8(2)18-7)27(24,25)21-12-9(14(23)26-3)5-4-6-10(12)16/h4-6,21H,1-3H3
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1.29E+3n/an/an/an/an/an/an/an/a



Central China Normal University

Curated by ChEMBL


Assay Description
Inhibition of wild type Arabidopsis thaliana acetolactate synthase by colorimetry


Bioorg Med Chem 18: 4897-904 (2010)

More data for this
Ligand-Target Pair
Acetolactate synthase


(Arabidopsis thaliana)
BDBM50487177
PNG
(CHEMBL2251959)
Show SMILES COC(=O)c1cccc(Cl)c1NS(=O)(=O)c1nc2nc(OC)ccn2n1
Show InChI InChI=1S/C14H12ClN5O5S/c1-24-10-6-7-20-13(16-10)17-14(18-20)26(22,23)19-11-8(12(21)25-2)4-3-5-9(11)15/h3-7,19H,1-2H3
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1.61E+3n/an/an/an/an/an/an/an/a



Central China Normal University

Curated by ChEMBL


Assay Description
Inhibition of wild type Arabidopsis thaliana acetolactate synthase by colorimetry


Bioorg Med Chem 18: 4897-904 (2010)

More data for this
Ligand-Target Pair
Acetolactate synthase


(Arabidopsis thaliana)
BDBM50486242
PNG
(CHEMBL2230130)
Show SMILES S(Sc1ccccc1)c1nc[nH]n1
Show InChI InChI=1S/C8H7N3S2/c1-2-4-7(5-3-1)12-13-8-9-6-10-11-8/h1-6H,(H,9,10,11)
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1.70E+3n/an/an/an/an/an/an/an/a



Nankai University

Curated by ChEMBL


Assay Description
Inhibition of wild type Arabidopsis thaliana acetohydroxyacid synthase colorimetric assay


J Agric Food Chem 60: 8286-93 (2012)

More data for this
Ligand-Target Pair
Acetolactate synthase


(Arabidopsis thaliana)
BDBM50487032
PNG
((R)-IMAZAQUIN)
Show SMILES CC(C)[C@@]1(C)N=C(NC1=O)c1nc2ccccc2cc1C(O)=O
Show InChI InChI=1S/C17H17N3O3/c1-9(2)17(3)16(23)19-14(20-17)13-11(15(21)22)8-10-6-4-5-7-12(10)18-13/h4-9H,1-3H3,(H,21,22)(H,19,20,23)/t17-/m1/s1
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3.00E+3n/an/an/an/an/an/an/an/a



University of Queensland

Curated by ChEMBL


Assay Description
Inhibition of Arabidopsis thaliana AHAS expressed in Escherichia coli strain BL21 (DE3) by colorimetric assay


Proc Natl Acad Sci USA 103: 569-73 (2006)

More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Acetolactate synthase


(Arabidopsis thaliana)
BDBM50486241
PNG
(CHEBI:5869 | IMAZAQUIN)
Show SMILES CC(C)C1(C)N=C(NC1=O)c1nc2ccccc2cc1C(O)=O
Show InChI InChI=1S/C17H17N3O3/c1-9(2)17(3)16(23)19-14(20-17)13-11(15(21)22)8-10-6-4-5-7-12(10)18-13/h4-9H,1-3H3,(H,21,22)(H,19,20,23)
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3.00E+3n/an/an/an/an/an/an/an/a



Nankai University

Curated by ChEMBL


Assay Description
Inhibition of wild type Arabidopsis thaliana acetohydroxyacid synthase colorimetric assay


J Agric Food Chem 60: 8286-93 (2012)

More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Acetolactate synthase


(Arabidopsis thaliana)
BDBM50486245
PNG
(CHEMBL2230131)
Show SMILES Cc1ccc(SSc2nc[nH]n2)cc1
Show InChI InChI=1S/C9H9N3S2/c1-7-2-4-8(5-3-7)13-14-9-10-6-11-12-9/h2-6H,1H3,(H,10,11,12)
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4.69E+3n/an/an/an/an/an/an/an/a



Nankai University

Curated by ChEMBL


Assay Description
Inhibition of wild type Arabidopsis thaliana acetohydroxyacid synthase colorimetric assay


J Agric Food Chem 60: 8286-93 (2012)

More data for this
Ligand-Target Pair
Acetolactate synthase


(Arabidopsis thaliana)
BDBM50487169
PNG
(CHEMBL2251950)
Show SMILES Cc1nc(cc2nc(nn12)S(=O)(=O)Nc1c(Cl)cccc1Cl)C(F)(F)F
Show InChI InChI=1S/C13H8Cl2F3N5O2S/c1-6-19-9(13(16,17)18)5-10-20-12(21-23(6)10)26(24,25)22-11-7(14)3-2-4-8(11)15/h2-5,22H,1H3
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5.02E+3n/an/an/an/an/an/an/an/a



Central China Normal University

Curated by ChEMBL


Assay Description
Inhibition of wild type Arabidopsis thaliana acetolactate synthase by colorimetry


Bioorg Med Chem 18: 4897-904 (2010)

More data for this
Ligand-Target Pair
Acetolactate synthase


(Arabidopsis thaliana)
BDBM50486244
PNG
(CHEMBL2229985)
Show SMILES Cc1nc(SSc2ccccc2[N+]([O-])=O)n[nH]1
Show InChI InChI=1S/C9H8N4O2S2/c1-6-10-9(12-11-6)17-16-8-5-3-2-4-7(8)13(14)15/h2-5H,1H3,(H,10,11,12)
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5.57E+3n/an/an/an/an/an/an/an/a



Nankai University

Curated by ChEMBL


Assay Description
Inhibition of wild type Arabidopsis thaliana acetohydroxyacid synthase colorimetric assay


J Agric Food Chem 60: 8286-93 (2012)

More data for this
Ligand-Target Pair
Acetolactate synthase


(Arabidopsis thaliana)
BDBM50487162
PNG
(CHEMBL2251953)
Show SMILES Cc1cc2nc(nn2c(C)n1)S(=O)(=O)Nc1cc(Cl)ccc1C
Show InChI InChI=1S/C14H14ClN5O2S/c1-8-4-5-11(15)7-12(8)19-23(21,22)14-17-13-6-9(2)16-10(3)20(13)18-14/h4-7,19H,1-3H3
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7.75E+3n/an/an/an/an/an/an/an/a



Central China Normal University

Curated by ChEMBL


Assay Description
Inhibition of wild type Arabidopsis thaliana acetolactate synthase by colorimetry


Bioorg Med Chem 18: 4897-904 (2010)

More data for this
Ligand-Target Pair
Acetolactate synthase


(Arabidopsis thaliana)
BDBM50486243
PNG
(MONOSULFURON ESTER)
Show SMILES COC(=O)c1ccccc1S(=O)(=O)NC(=O)Nc1nccc(C)n1
Show InChI InChI=1S/C14H14N4O5S/c1-9-7-8-15-13(16-9)17-14(20)18-24(21,22)11-6-4-3-5-10(11)12(19)23-2/h3-8H,1-2H3,(H2,15,16,17,18,20)
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8.53E+3n/an/an/an/an/an/an/an/a



Nankai University

Curated by ChEMBL


Assay Description
Inhibition of Arabidopsis thaliana acetohydroxyacid synthase W574L mutant colorimetric assay


J Agric Food Chem 60: 8286-93 (2012)

More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Acetolactate synthase


(Arabidopsis thaliana)
BDBM50487176
PNG
(CHEMBL2251938)
Show SMILES COc1ccn2nc(nc2n1)S(=O)(=O)Nc1cccc(Cl)c1Cl
Show InChI InChI=1S/C12H9Cl2N5O3S/c1-22-9-5-6-19-11(15-9)16-12(17-19)23(20,21)18-8-4-2-3-7(13)10(8)14/h2-6,18H,1H3
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1.48E+4n/an/an/an/an/an/an/an/a



Central China Normal University

Curated by ChEMBL


Assay Description
Inhibition of wild type Arabidopsis thaliana acetolactate synthase by colorimetry


Bioorg Med Chem 18: 4897-904 (2010)

More data for this
Ligand-Target Pair
Acetolactate synthase


(Arabidopsis thaliana)
BDBM50487168
PNG
(CHEMBL2251955)
Show SMILES COc1ccn2nc(nc2n1)S(=O)(=O)Nc1c(F)cccc1F
Show InChI InChI=1S/C12H9F2N5O3S/c1-22-9-5-6-19-11(15-9)16-12(17-19)23(20,21)18-10-7(13)3-2-4-8(10)14/h2-6,18H,1H3
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1.85E+4n/an/an/an/an/an/an/an/a



Central China Normal University

Curated by ChEMBL


Assay Description
Inhibition of wild type Arabidopsis thaliana acetolactate synthase by colorimetry


Bioorg Med Chem 18: 4897-904 (2010)

More data for this
Ligand-Target Pair
Acetolactate synthase


(Arabidopsis thaliana)
BDBM50487175
PNG
(CHEMBL2251939)
Show SMILES COc1ccn2nc(nc2n1)S(=O)(=O)Nc1ccccc1Br
Show InChI InChI=1S/C12H10BrN5O3S/c1-21-10-6-7-18-11(14-10)15-12(16-18)22(19,20)17-9-5-3-2-4-8(9)13/h2-7,17H,1H3
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2.26E+4n/an/an/an/an/an/an/an/a



Central China Normal University

Curated by ChEMBL


Assay Description
Inhibition of wild type Arabidopsis thaliana acetolactate synthase by colorimetry


Bioorg Med Chem 18: 4897-904 (2010)

More data for this
Ligand-Target Pair
Acetolactate synthase


(Arabidopsis thaliana)
BDBM50486242
PNG
(CHEMBL2230130)
Show SMILES S(Sc1ccccc1)c1nc[nH]n1
Show InChI InChI=1S/C8H7N3S2/c1-2-4-7(5-3-1)12-13-8-9-6-10-11-8/h1-6H,(H,9,10,11)
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2.45E+4n/an/an/an/an/an/an/an/a



Nankai University

Curated by ChEMBL


Assay Description
Inhibition of Arabidopsis thaliana acetohydroxyacid synthase W574L mutant colorimetric assay


J Agric Food Chem 60: 8286-93 (2012)

More data for this
Ligand-Target Pair
Acetolactate synthase


(Arabidopsis thaliana)
BDBM50486245
PNG
(CHEMBL2230131)
Show SMILES Cc1ccc(SSc2nc[nH]n2)cc1
Show InChI InChI=1S/C9H9N3S2/c1-7-2-4-8(5-3-7)13-14-9-10-6-11-12-9/h2-6H,1H3,(H,10,11,12)
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2.57E+4n/an/an/an/an/an/an/an/a



Nankai University

Curated by ChEMBL


Assay Description
Inhibition of Arabidopsis thaliana acetohydroxyacid synthase W574L mutant colorimetric assay


J Agric Food Chem 60: 8286-93 (2012)

More data for this
Ligand-Target Pair
Acetolactate synthase


(Arabidopsis thaliana)
BDBM50487165
PNG
(CHEMBL2251943)
Show SMILES Cc1nc(C)n2nc(nc2c1Cl)S(=O)(=O)Nc1ccccc1F
Show InChI InChI=1S/C13H11ClFN5O2S/c1-7-11(14)12-17-13(18-20(12)8(2)16-7)23(21,22)19-10-6-4-3-5-9(10)15/h3-6,19H,1-2H3
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2.58E+4n/an/an/an/an/an/an/an/a



Central China Normal University

Curated by ChEMBL


Assay Description
Inhibition of wild type Arabidopsis thaliana acetolactate synthase by colorimetry


Bioorg Med Chem 18: 4897-904 (2010)

More data for this
Ligand-Target Pair
Acetolactate synthase


(Arabidopsis thaliana)
BDBM50487181
PNG
(CHEMBL2251958)
Show SMILES COc1ccn2nc(nc2n1)S(=O)(=O)Nc1ccccc1F
Show InChI InChI=1S/C12H10FN5O3S/c1-21-10-6-7-18-11(14-10)15-12(16-18)22(19,20)17-9-5-3-2-4-8(9)13/h2-7,17H,1H3
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2.59E+4n/an/an/an/an/an/an/an/a



Central China Normal University

Curated by ChEMBL


Assay Description
Inhibition of wild type Arabidopsis thaliana acetolactate synthase by colorimetry


Bioorg Med Chem 18: 4897-904 (2010)

More data for this
Ligand-Target Pair
Acetolactate synthase


(Arabidopsis thaliana)
BDBM50486244
PNG
(CHEMBL2229985)
Show SMILES Cc1nc(SSc2ccccc2[N+]([O-])=O)n[nH]1
Show InChI InChI=1S/C9H8N4O2S2/c1-6-10-9(12-11-6)17-16-8-5-3-2-4-7(8)13(14)15/h2-5H,1H3,(H,10,11,12)
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2.71E+4n/an/an/an/an/an/an/an/a



Nankai University

Curated by ChEMBL


Assay Description
Inhibition of Arabidopsis thaliana acetohydroxyacid synthase W574L mutant colorimetric assay


J Agric Food Chem 60: 8286-93 (2012)

More data for this
Ligand-Target Pair
Acetolactate synthase


(Arabidopsis thaliana)
BDBM50487166
PNG
(CHEMBL2251947)
Show SMILES Cc1cc2nc(nn2c(C)n1)S(=O)(=O)Nc1ccccc1F
Show InChI InChI=1S/C13H12FN5O2S/c1-8-7-12-16-13(17-19(12)9(2)15-8)22(20,21)18-11-6-4-3-5-10(11)14/h3-7,18H,1-2H3
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2.77E+4n/an/an/an/an/an/an/an/a



Central China Normal University

Curated by ChEMBL


Assay Description
Inhibition of wild type Arabidopsis thaliana acetolactate synthase by colorimetry


Bioorg Med Chem 18: 4897-904 (2010)

More data for this
Ligand-Target Pair
Acetolactate synthase


(Arabidopsis thaliana)
BDBM50487182
PNG
(CHEMBL2251954)
Show SMILES Cc1cc2nc(nn2c(C)n1)S(=O)(=O)Nc1cc(F)ccc1F
Show InChI InChI=1S/C13H11F2N5O2S/c1-7-5-12-17-13(18-20(12)8(2)16-7)23(21,22)19-11-6-9(14)3-4-10(11)15/h3-6,19H,1-2H3
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2.81E+4n/an/an/an/an/an/an/an/a



Central China Normal University

Curated by ChEMBL


Assay Description
Inhibition of wild type Arabidopsis thaliana acetolactate synthase by colorimetry


Bioorg Med Chem 18: 4897-904 (2010)

More data for this
Ligand-Target Pair
Acetolactate synthase


(Arabidopsis thaliana)
BDBM50487167
PNG
(CHEMBL2251957)
Show SMILES COc1ccn2nc(nc2n1)S(=O)(=O)Nc1cc(F)ccc1F
Show InChI InChI=1S/C12H9F2N5O3S/c1-22-10-4-5-19-11(15-10)16-12(17-19)23(20,21)18-9-6-7(13)2-3-8(9)14/h2-6,18H,1H3
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5.33E+4n/an/an/an/an/an/an/an/a



Central China Normal University

Curated by ChEMBL


Assay Description
Inhibition of wild type Arabidopsis thaliana acetolactate synthase by colorimetry


Bioorg Med Chem 18: 4897-904 (2010)

More data for this
Ligand-Target Pair
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