Compile Data Set for Download or QSAR

PubMed code 20598554

Found 23 hits of Enzyme Inhibition Constant Data   

TargetAcetolactate synthase, chloroplastic(Arabidopsis thaliana)
Central China Normal University

Curated by ChEMBL
LigandPNGBDBM50004708(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
Affinity DataKi:  360nMAssay Description:Inhibition of wild type Arabidopsis thaliana acetolactate synthase by colorimetryMore data for this Ligand-Target Pair
TargetAcetolactate synthase, chloroplastic(Arabidopsis thaliana)
Central China Normal University

Curated by ChEMBL
LigandPNGBDBM50487171(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
Affinity DataKi:  1.29E+3nMAssay Description:Inhibition of wild type Arabidopsis thaliana acetolactate synthase by colorimetryMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetAcetolactate synthase, chloroplastic(Arabidopsis thaliana)
Central China Normal University

Curated by ChEMBL
LigandPNGBDBM50487177(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
Affinity DataKi:  1.61E+3nMAssay Description:Inhibition of wild type Arabidopsis thaliana acetolactate synthase by colorimetryMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetAcetolactate synthase, chloroplastic(Arabidopsis thaliana)
Central China Normal University

Curated by ChEMBL
LigandPNGBDBM50487169(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
Affinity DataKi:  5.02E+3nMAssay Description:Inhibition of wild type Arabidopsis thaliana acetolactate synthase by colorimetryMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetAcetolactate synthase, chloroplastic(Arabidopsis thaliana)
Central China Normal University

Curated by ChEMBL
LigandPNGBDBM50487162(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
Affinity DataKi:  7.75E+3nMAssay Description:Inhibition of wild type Arabidopsis thaliana acetolactate synthase by colorimetryMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetAcetolactate synthase, chloroplastic(Arabidopsis thaliana)
Central China Normal University

Curated by ChEMBL
LigandPNGBDBM50487176(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
Affinity DataKi:  1.48E+4nMAssay Description:Inhibition of wild type Arabidopsis thaliana acetolactate synthase by colorimetryMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetAcetolactate synthase, chloroplastic(Arabidopsis thaliana)
Central China Normal University

Curated by ChEMBL
LigandPNGBDBM50487168(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
Affinity DataKi:  1.85E+4nMAssay Description:Inhibition of wild type Arabidopsis thaliana acetolactate synthase by colorimetryMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetAcetolactate synthase, chloroplastic(Arabidopsis thaliana)
Central China Normal University

Curated by ChEMBL
LigandPNGBDBM50487175(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
Affinity DataKi:  2.26E+4nMAssay Description:Inhibition of wild type Arabidopsis thaliana acetolactate synthase by colorimetryMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetAcetolactate synthase, chloroplastic(Arabidopsis thaliana)
Central China Normal University

Curated by ChEMBL
LigandPNGBDBM50487165(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
Affinity DataKi:  2.58E+4nMAssay Description:Inhibition of wild type Arabidopsis thaliana acetolactate synthase by colorimetryMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetAcetolactate synthase, chloroplastic(Arabidopsis thaliana)
Central China Normal University

Curated by ChEMBL
LigandPNGBDBM50487181(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
Affinity DataKi:  2.59E+4nMAssay Description:Inhibition of wild type Arabidopsis thaliana acetolactate synthase by colorimetryMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetAcetolactate synthase, chloroplastic(Arabidopsis thaliana)
Central China Normal University

Curated by ChEMBL
LigandPNGBDBM50487166(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
Affinity DataKi:  2.77E+4nMAssay Description:Inhibition of wild type Arabidopsis thaliana acetolactate synthase by colorimetryMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetAcetolactate synthase, chloroplastic(Arabidopsis thaliana)
Central China Normal University

Curated by ChEMBL
LigandPNGBDBM50487182(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
Affinity DataKi:  2.81E+4nMAssay Description:Inhibition of wild type Arabidopsis thaliana acetolactate synthase by colorimetryMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetAcetolactate synthase, chloroplastic(Arabidopsis thaliana)
Central China Normal University

Curated by ChEMBL
LigandPNGBDBM50487167(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
Affinity DataKi:  5.33E+4nMAssay Description:Inhibition of wild type Arabidopsis thaliana acetolactate synthase by colorimetryMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetAcetolactate synthase, chloroplastic(Arabidopsis thaliana)
Central China Normal University

Curated by ChEMBL
LigandPNGBDBM50487173(CHEMBL2251942)
Show SMILES Cc1nc(cc2nc(nn12)S(=O)(=O)Nc1c(F)cccc1F)C(F)(F)F
Show InChI InChI=1S/C13H8F5N5O2S/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
Affinity DataKi:  7.06E+4nMAssay Description:Inhibition of wild type Arabidopsis thaliana acetolactate synthase by colorimetryMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetAcetolactate synthase, chloroplastic(Arabidopsis thaliana)
Central China Normal University

Curated by ChEMBL
LigandPNGBDBM50487179(CHEMBL2251952)
Show SMILES Cc1cc2nc(nn2c(C)n1)S(=O)(=O)Nc1ccc(cc1Cl)C(F)(F)F
Show InChI InChI=1S/C14H11ClF3N5O2S/c1-7-5-12-20-13(21-23(12)8(2)19-7)26(24,25)22-11-4-3-9(6-10(11)15)14(16,17)18/h3-6,22H,1-2H3
Affinity DataKi:  1.78E+5nMAssay Description:Inhibition of wild type Arabidopsis thaliana acetolactate synthase by colorimetryMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetAcetolactate synthase, chloroplastic(Arabidopsis thaliana)
Central China Normal University

Curated by ChEMBL
LigandPNGBDBM50487170(CHEMBL2251949)
Show SMILES Cc1nc(cc2nc(nn12)S(=O)(=O)Nc1ccccc1F)C(F)(F)F
Show InChI InChI=1S/C13H9F4N5O2S/c1-7-18-10(13(15,16)17)6-11-19-12(20-22(7)11)25(23,24)21-9-5-3-2-4-8(9)14/h2-6,21H,1H3
Affinity DataKi:  5.69E+5nMAssay Description:Inhibition of wild type Arabidopsis thaliana acetolactate synthase by colorimetryMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetAcetolactate synthase, chloroplastic(Arabidopsis thaliana)
Central China Normal University

Curated by ChEMBL
LigandPNGBDBM50487172(CHEMBL2251944)
Show SMILES Cc1cc2nc(nn2c(C)n1)S(=O)(=O)Nc1ccc(F)c(F)c1F
Show InChI InChI=1S/C13H10F3N5O2S/c1-6-5-10-18-13(19-21(10)7(2)17-6)24(22,23)20-9-4-3-8(14)11(15)12(9)16/h3-5,20H,1-2H3
Affinity DataKi: >1.00E+6nMAssay Description:Inhibition of wild type Arabidopsis thaliana acetolactate synthase by colorimetryMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetAcetolactate synthase, chloroplastic(Arabidopsis thaliana)
Central China Normal University

Curated by ChEMBL
LigandPNGBDBM50487183(CHEMBL2251945)
Show SMILES Cc1nc(cc2nc(nn12)S(=O)(=O)Nc1ccc(F)c(F)c1F)C(F)(F)F
Show InChI InChI=1S/C13H7F6N5O2S/c1-5-20-8(13(17,18)19)4-9-21-12(22-24(5)9)27(25,26)23-7-3-2-6(14)10(15)11(7)16/h2-4,23H,1H3
Affinity DataKi: >1.00E+6nMAssay Description:Inhibition of wild type Arabidopsis thaliana acetolactate synthase by colorimetryMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetAcetolactate synthase, chloroplastic(Arabidopsis thaliana)
Central China Normal University

Curated by ChEMBL
LigandPNGBDBM50487163(CHEMBL2251946)
Show SMILES Cc1nc(C)n2nc(nc2c1Cl)S(=O)(=O)Nc1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C14H11ClF3N5O2S/c1-7-11(15)12-20-13(21-23(12)8(2)19-7)26(24,25)22-10-5-3-9(4-6-10)14(16,17)18/h3-6,22H,1-2H3
Affinity DataKi: >1.00E+6nMAssay Description:Inhibition of wild type Arabidopsis thaliana acetolactate synthase by colorimetryMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetAcetolactate synthase, chloroplastic(Arabidopsis thaliana)
Central China Normal University

Curated by ChEMBL
LigandPNGBDBM50487164(CHEMBL2251937)
Show SMILES COc1ccn2nc(nc2n1)S(=O)(=O)Nc1ccc(Br)cc1
Show InChI InChI=1S/C12H10BrN5O3S/c1-21-10-6-7-18-11(14-10)15-12(16-18)22(19,20)17-9-4-2-8(13)3-5-9/h2-7,17H,1H3
Affinity DataKi: >1.00E+6nMAssay Description:Inhibition of wild type Arabidopsis thaliana acetolactate synthase by colorimetryMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetAcetolactate synthase, chloroplastic(Arabidopsis thaliana)
Central China Normal University

Curated by ChEMBL
LigandPNGBDBM50487180(CHEMBL2251940)
Show SMILES COc1ccn2nc(nc2n1)S(=O)(=O)Nc1ccc(OC(F)(F)F)cc1
Show InChI InChI=1S/C13H10F3N5O4S/c1-24-10-6-7-21-11(17-10)18-12(19-21)26(22,23)20-8-2-4-9(5-3-8)25-13(14,15)16/h2-7,20H,1H3
Affinity DataKi: >1.00E+6nMAssay Description:Inhibition of wild type Arabidopsis thaliana acetolactate synthase by colorimetryMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetAcetolactate synthase, chloroplastic(Arabidopsis thaliana)
Central China Normal University

Curated by ChEMBL
LigandPNGBDBM50487178(CHEMBL2251956)
Show SMILES COc1ccn2nc(nc2n1)S(=O)(=O)Nc1cc(F)c(F)c(F)c1
Show InChI InChI=1S/C12H8F3N5O3S/c1-23-9-2-3-20-11(16-9)17-12(18-20)24(21,22)19-6-4-7(13)10(15)8(14)5-6/h2-5,19H,1H3
Affinity DataKi: >1.00E+6nMAssay Description:Inhibition of wild type Arabidopsis thaliana acetolactate synthase by colorimetryMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetAcetolactate synthase, chloroplastic(Arabidopsis thaliana)
Central China Normal University

Curated by ChEMBL
LigandPNGBDBM50487174(CHEMBL2251941)
Show SMILES Cc1nc(C)n2nc(nc2c1Cl)S(=O)(=O)Nc1ccc(F)c(F)c1F
Show InChI InChI=1S/C13H9ClF3N5O2S/c1-5-9(14)12-19-13(20-22(12)6(2)18-5)25(23,24)21-8-4-3-7(15)10(16)11(8)17/h3-4,21H,1-2H3
Affinity DataKi: >1.00E+6nMAssay Description:Inhibition of wild type Arabidopsis thaliana acetolactate synthase by colorimetryMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
* indicates data uncertainty>20%