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Compile Data Set for Download or QSAR

Found 53 hits Enz. Inhib. hit(s) with Target = 'Dihydroorotate dehydrogenase' AND taxid = 5823   
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
Dihydroorotate Dehydrogenase (DHODH)


(Plasmodium berghei)
BDBM92606
PNG
(DHOD Inhibitor, 5 | US8703811, 6)
Show SMILES CCOC(=O)c1[nH]c(C)c(Cc2ccc(OCC)cc2)c1C
Show InChI InChI=1S/C18H23NO3/c1-5-21-15-9-7-14(8-10-15)11-16-12(3)17(19-13(16)4)18(20)22-6-2/h7-10,19H,5-6,11H2,1-4H3
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US Patent
n/an/a 60n/an/an/an/an/an/a



Genzyme Corporation; Massachusetts Institute of Technology; President and Fellows of Harvard College

US Patent


Assay Description
Type 2 DHODH activity was monitored with either the direct assay measuring the formation of orotate or via a chromogen reduction assay using DCIP. Al...


US Patent US8703811 (2014)

More data for this
Ligand-Target Pair
Dihydroorotate Dehydrogenase (DHODH)


(Plasmodium berghei)
BDBM92604
PNG
(DHOD Inhibitor, 3 | US8703811, 1)
Show SMILES CCCNC(=O)c1ccc(s1)-n1c(C)cc2ccccc12
Show InChI InChI=1S/C17H18N2OS/c1-3-10-18-17(20)15-8-9-16(21-15)19-12(2)11-13-6-4-5-7-14(13)19/h4-9,11H,3,10H2,1-2H3,(H,18,20)
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PubMed
n/an/a 60n/an/an/an/an/an/a



Harvard Medical School



Assay Description
Assay was determined using a continuous assay.


Citation and Details
More data for this
Ligand-Target Pair
Dihydroorotate Dehydrogenase (DHODH)


(Plasmodium berghei)
BDBM92606
PNG
(DHOD Inhibitor, 5 | US8703811, 6)
Show SMILES CCOC(=O)c1[nH]c(C)c(Cc2ccc(OCC)cc2)c1C
Show InChI InChI=1S/C18H23NO3/c1-5-21-15-9-7-14(8-10-15)11-16-12(3)17(19-13(16)4)18(20)22-6-2/h7-10,19H,5-6,11H2,1-4H3
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n/an/a 60n/an/an/an/an/an/a



Harvard Medical School



Assay Description
Assay was determined using a continuous assay.


Citation and Details
More data for this
Ligand-Target Pair
Dihydroorotate Dehydrogenase (DHODH)


(Plasmodium berghei)
BDBM92604
PNG
(DHOD Inhibitor, 3 | US8703811, 1)
Show SMILES CCCNC(=O)c1ccc(s1)-n1c(C)cc2ccccc12
Show InChI InChI=1S/C17H18N2OS/c1-3-10-18-17(20)15-8-9-16(21-15)19-12(2)11-13-6-4-5-7-14(13)19/h4-9,11H,3,10H2,1-2H3,(H,18,20)
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US Patent
n/an/a 60n/an/an/an/an/an/a



Genzyme Corporation; Massachusetts Institute of Technology; President and Fellows of Harvard College

US Patent


Assay Description
Type 2 DHODH activity was monitored with either the direct assay measuring the formation of orotate or via a chromogen reduction assay using DCIP. Al...


US Patent US8703811 (2014)

More data for this
Ligand-Target Pair
Dihydroorotate Dehydrogenase (DHODH)


(Plasmodium berghei)
BDBM92603
PNG
(DHOD Inhibitor, 2 | US8703811, 3)
Show SMILES CCCCCC1CCCc2c(O)c3ccccc3nc12
Show InChI InChI=1S/C18H23NO/c1-2-3-4-8-13-9-7-11-15-17(13)19-16-12-6-5-10-14(16)18(15)20/h5-6,10,12-13H,2-4,7-9,11H2,1H3,(H,19,20)
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US Patent
n/an/a 110n/an/an/an/an/an/a



Genzyme Corporation; Massachusetts Institute of Technology; President and Fellows of Harvard College

US Patent


Assay Description
Type 2 DHODH activity was monitored with either the direct assay measuring the formation of orotate or via a chromogen reduction assay using DCIP. Al...


US Patent US8703811 (2014)

More data for this
Ligand-Target Pair
Dihydroorotate Dehydrogenase (DHODH)


(Plasmodium berghei)
BDBM92603
PNG
(DHOD Inhibitor, 2 | US8703811, 3)
Show SMILES CCCCCC1CCCc2c(O)c3ccccc3nc12
Show InChI InChI=1S/C18H23NO/c1-2-3-4-8-13-9-7-11-15-17(13)19-16-12-6-5-10-14(16)18(15)20/h5-6,10,12-13H,2-4,7-9,11H2,1H3,(H,19,20)
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PubMed
n/an/a 110n/an/an/an/an/an/a



Harvard Medical School



Assay Description
Assay was determined using a continuous assay.


Citation and Details
More data for this
Ligand-Target Pair
Dihydroorotate Dehydrogenase (DHODH)


(Plasmodium berghei)
BDBM24400
PNG
(5-methyl-N-(naphthalen-2-yl)-[1,2,4]triazolo[1,5-a...)
Show SMILES Cc1cc(Nc2ccc3ccccc3c2)n2ncnc2n1
Show InChI InChI=1S/C16H13N5/c1-11-8-15(21-16(19-11)17-10-18-21)20-14-7-6-12-4-2-3-5-13(12)9-14/h2-10,20H,1H3
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n/an/a 230n/an/an/an/a8.020



University of Washington at Seattle



Assay Description
The assays were carried out by using a colorimetric DCIP method, which uses the colorimetric reagent 2, 6-dichlorophenolindophenol as the final elect...


Citation and Details
More data for this
Ligand-Target Pair
Dihydroorotate Dehydrogenase (DHODH)


(Plasmodium berghei)
BDBM28843
PNG
(N-[3-fluoro-4-(trifluoromethyl)phenyl]-5-methyl-[1...)
Show SMILES Cc1cc(Nc2ccc(c(F)c2)C(F)(F)F)n2ncnc2n1
Show InChI InChI=1S/C13H9F4N5/c1-7-4-11(22-12(20-7)18-6-19-22)21-8-2-3-9(10(14)5-8)13(15,16)17/h2-6,21H,1H3
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PubMed
n/an/a 260n/an/an/an/a8.020



University of Washington at Seattle



Assay Description
The assays were carried out by using a colorimetric DCIP method, which uses the colorimetric reagent 2, 6-dichlorophenolindophenol as the final elect...


Citation and Details
More data for this
Ligand-Target Pair
Dihydroorotate Dehydrogenase (DHODH)


(Plasmodium berghei)
BDBM28817
PNG
(5-methyl-N-[4-(trifluoromethyl)phenyl]-[1,2,4]tria...)
Show SMILES Cc1cc(Nc2ccc(cc2)C(F)(F)F)n2ncnc2n1
Show InChI InChI=1S/C13H10F3N5/c1-8-6-11(21-12(19-8)17-7-18-21)20-10-4-2-9(3-5-10)13(14,15)16/h2-7,20H,1H3
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PubMed
n/an/a 380n/an/an/an/a8.020



University of Washington at Seattle



Assay Description
The assays were carried out by using a colorimetric DCIP method, which uses the colorimetric reagent 2, 6-dichlorophenolindophenol as the final elect...


Citation and Details
More data for this
Ligand-Target Pair
Dihydroorotate Dehydrogenase (DHODH)


(Plasmodium berghei)
BDBM92605
PNG
(DHOD Inhibitor, 4 | US8703811, 5)
Show SMILES O=C(NC1CC1)c1ccc(s1)N1CCSc2ccccc12
Show InChI InChI=1S/C16H16N2OS2/c19-16(17-11-5-6-11)14-7-8-15(21-14)18-9-10-20-13-4-2-1-3-12(13)18/h1-4,7-8,11H,5-6,9-10H2,(H,17,19)
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PubMed
n/an/a 380n/an/an/an/an/an/a



Harvard Medical School



Assay Description
Assay was determined using a continuous assay.


Citation and Details
More data for this
Ligand-Target Pair
Dihydroorotate Dehydrogenase (DHODH)


(Plasmodium berghei)
BDBM92605
PNG
(DHOD Inhibitor, 4 | US8703811, 5)
Show SMILES O=C(NC1CC1)c1ccc(s1)N1CCSc2ccccc12
Show InChI InChI=1S/C16H16N2OS2/c19-16(17-11-5-6-11)14-7-8-15(21-14)18-9-10-20-13-4-2-1-3-12(13)18/h1-4,7-8,11H,5-6,9-10H2,(H,17,19)
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US Patent
n/an/a 380n/an/an/an/an/an/a



Genzyme Corporation; Massachusetts Institute of Technology; President and Fellows of Harvard College

US Patent


Assay Description
Type 2 DHODH activity was monitored with either the direct assay measuring the formation of orotate or via a chromogen reduction assay using DCIP. Al...


US Patent US8703811 (2014)

More data for this
Ligand-Target Pair
Dihydroorotate Dehydrogenase (DHODH)


(Plasmodium berghei)
BDBM92602
PNG
(DHOD Inhibitor, 1 | US8703811, 2)
Show SMILES Cc1ccccc1C=Cc1cc(O)c2ccccc2n1
Show InChI InChI=1S/C18H15NO/c1-13-6-2-3-7-14(13)10-11-15-12-18(20)16-8-4-5-9-17(16)19-15/h2-12H,1H3,(H,19,20)
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PubMed
n/an/a 560n/an/an/an/an/an/a



Harvard Medical School



Assay Description
Assay was determined using a continuous assay.


Citation and Details
More data for this
Ligand-Target Pair
Dihydroorotate Dehydrogenase (DHODH)


(Plasmodium berghei)
BDBM92602
PNG
(DHOD Inhibitor, 1 | US8703811, 2)
Show SMILES Cc1ccccc1C=Cc1cc(O)c2ccccc2n1
Show InChI InChI=1S/C18H15NO/c1-13-6-2-3-7-14(13)10-11-15-12-18(20)16-8-4-5-9-17(16)19-15/h2-12H,1H3,(H,19,20)
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US Patent
n/an/a 560n/an/an/an/an/an/a



Genzyme Corporation; Massachusetts Institute of Technology; President and Fellows of Harvard College

US Patent


Assay Description
Type 2 DHODH activity was monitored with either the direct assay measuring the formation of orotate or via a chromogen reduction assay using DCIP. Al...


US Patent US8703811 (2014)

More data for this
Ligand-Target Pair
Dihydroorotate Dehydrogenase (DHODH)


(Plasmodium berghei)
BDBM28815
PNG
(N-(4-bromophenyl)-5-methyl-[1,2,4]triazolo[1,5-a]p...)
Show SMILES Cc1cc(Nc2ccc(Br)cc2)n2ncnc2n1
Show InChI InChI=1S/C12H10BrN5/c1-8-6-11(18-12(16-8)14-7-15-18)17-10-4-2-9(13)3-5-10/h2-7,17H,1H3
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PubMed
n/an/a 1.30E+3n/an/an/an/a8.020



University of Washington at Seattle



Assay Description
The assays were carried out by using a colorimetric DCIP method, which uses the colorimetric reagent 2, 6-dichlorophenolindophenol as the final elect...


Citation and Details
More data for this
Ligand-Target Pair
Dihydroorotate Dehydrogenase (DHODH)


(Plasmodium berghei)
BDBM28838
PNG
(N-[4-bromo-3-(trifluoromethyl)phenyl]-5-methyl-[1,...)
Show SMILES Cc1cc(Nc2ccc(Br)c(c2)C(F)(F)F)n2ncnc2n1
Show InChI InChI=1S/C13H9BrF3N5/c1-7-4-11(22-12(20-7)18-6-19-22)21-8-2-3-10(14)9(5-8)13(15,16)17/h2-6,21H,1H3
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PubMed
n/an/a 1.50E+3n/an/an/an/a8.020



University of Washington at Seattle



Assay Description
The assays were carried out by using a colorimetric DCIP method, which uses the colorimetric reagent 2, 6-dichlorophenolindophenol as the final elect...


Citation and Details
More data for this
Ligand-Target Pair
Dihydroorotate Dehydrogenase (DHODH)


(Plasmodium berghei)
BDBM28837
PNG
(N-[4-chloro-3-(trifluoromethyl)phenyl]-5-methyl-[1...)
Show SMILES Cc1cc(Nc2ccc(Cl)c(c2)C(F)(F)F)n2ncnc2n1
Show InChI InChI=1S/C13H9ClF3N5/c1-7-4-11(22-12(20-7)18-6-19-22)21-8-2-3-10(14)9(5-8)13(15,16)17/h2-6,21H,1H3
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PubMed
n/an/a 2.40E+3n/an/an/an/a8.020



University of Washington at Seattle



Assay Description
The assays were carried out by using a colorimetric DCIP method, which uses the colorimetric reagent 2, 6-dichlorophenolindophenol as the final elect...


Citation and Details
More data for this
Ligand-Target Pair
Dihydroorotate Dehydrogenase (DHODH)


(Plasmodium berghei)
BDBM28842
PNG
(N-(3-fluoro-4-methylphenyl)-5-methyl-[1,2,4]triazo...)
Show SMILES Cc1cc(Nc2ccc(C)c(F)c2)n2ncnc2n1
Show InChI InChI=1S/C13H12FN5/c1-8-3-4-10(6-11(8)14)18-12-5-9(2)17-13-15-7-16-19(12)13/h3-7,18H,1-2H3
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PubMed
n/an/a 3.20E+3n/an/an/an/a8.020



University of Washington at Seattle



Assay Description
The assays were carried out by using a colorimetric DCIP method, which uses the colorimetric reagent 2, 6-dichlorophenolindophenol as the final elect...


Citation and Details
More data for this
Ligand-Target Pair
Dihydroorotate Dehydrogenase (DHODH)


(Plasmodium berghei)
BDBM28821
PNG
(5-methyl-N-(4-nitrophenyl)-[1,2,4]triazolo[1,5-a]p...)
Show SMILES Cc1cc(Nc2ccc(cc2)[N+]([O-])=O)n2ncnc2n1
Show InChI InChI=1S/C12H10N6O2/c1-8-6-11(17-12(15-8)13-7-14-17)16-9-2-4-10(5-3-9)18(19)20/h2-7,16H,1H3
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n/an/a 3.70E+3n/an/an/an/a8.020



University of Washington at Seattle



Assay Description
The assays were carried out by using a colorimetric DCIP method, which uses the colorimetric reagent 2, 6-dichlorophenolindophenol as the final elect...


Citation and Details
More data for this
Ligand-Target Pair
Dihydroorotate Dehydrogenase (DHODH)


(Plasmodium berghei)
BDBM24413
PNG
(JMC521864 Compund DSM2 | N-(anthracen-2-yl)-5-meth...)
Show SMILES Cc1cc(Nc2ccc3cc4ccccc4cc3c2)n2ncnc2n1
Show InChI InChI=1S/C20H15N5/c1-13-8-19(25-20(23-13)21-12-22-25)24-18-7-6-16-9-14-4-2-3-5-15(14)10-17(16)11-18/h2-12,24H,1H3
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n/an/a 3.70E+3n/an/an/an/a8.020



University of Washington at Seattle



Assay Description
The assays were carried out by using a colorimetric DCIP method, which uses the colorimetric reagent 2, 6-dichlorophenolindophenol as the final elect...


Citation and Details
More data for this
Ligand-Target Pair
Dihydroorotate Dehydrogenase (DHODH)


(Plasmodium berghei)
BDBM28840
PNG
(N-(3,4-dimethylphenyl)-5-methyl-[1,2,4]triazolo[1,...)
Show SMILES Cc1cc(Nc2ccc(C)c(C)c2)n2ncnc2n1
Show InChI InChI=1S/C14H15N5/c1-9-4-5-12(6-10(9)2)18-13-7-11(3)17-14-15-8-16-19(13)14/h4-8,18H,1-3H3
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n/an/a 4.00E+3n/an/an/an/a8.020



University of Washington at Seattle



Assay Description
The assays were carried out by using a colorimetric DCIP method, which uses the colorimetric reagent 2, 6-dichlorophenolindophenol as the final elect...


Citation and Details
More data for this
Ligand-Target Pair
Dihydroorotate Dehydrogenase (DHODH)


(Plasmodium berghei)
BDBM28819
PNG
(5-methyl-N-[4-(trifluoromethoxy)phenyl]-[1,2,4]tri...)
Show SMILES Cc1cc(Nc2ccc(OC(F)(F)F)cc2)n2ncnc2n1
Show InChI InChI=1S/C13H10F3N5O/c1-8-6-11(21-12(19-8)17-7-18-21)20-9-2-4-10(5-3-9)22-13(14,15)16/h2-7,20H,1H3
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n/an/a 4.00E+3n/an/an/an/a8.020



University of Washington at Seattle



Assay Description
The assays were carried out by using a colorimetric DCIP method, which uses the colorimetric reagent 2, 6-dichlorophenolindophenol as the final elect...


Citation and Details
More data for this
Ligand-Target Pair
Dihydroorotate Dehydrogenase (DHODH)


(Plasmodium berghei)
BDBM28814
PNG
(N-(4-chlorophenyl)-5-methyl-[1,2,4]triazolo[1,5-a]...)
Show SMILES Cc1cc(Nc2ccc(Cl)cc2)n2ncnc2n1
Show InChI InChI=1S/C12H10ClN5/c1-8-6-11(18-12(16-8)14-7-15-18)17-10-4-2-9(13)3-5-10/h2-7,17H,1H3
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n/an/a 5.70E+3n/an/an/an/a8.020



University of Washington at Seattle



Assay Description
The assays were carried out by using a colorimetric DCIP method, which uses the colorimetric reagent 2, 6-dichlorophenolindophenol as the final elect...


Citation and Details
More data for this
Ligand-Target Pair
Dihydroorotate Dehydrogenase (DHODH)


(Plasmodium berghei)
BDBM28839
PNG
(5-methyl-N-[4-methyl-3-(trifluoromethyl)phenyl]-[1...)
Show SMILES Cc1cc(Nc2ccc(C)c(c2)C(F)(F)F)n2ncnc2n1
Show InChI InChI=1S/C14H12F3N5/c1-8-3-4-10(6-11(8)14(15,16)17)21-12-5-9(2)20-13-18-7-19-22(12)13/h3-7,21H,1-2H3
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PubMed
n/an/a 7.30E+3n/an/an/an/a8.020



University of Washington at Seattle



Assay Description
The assays were carried out by using a colorimetric DCIP method, which uses the colorimetric reagent 2, 6-dichlorophenolindophenol as the final elect...


Citation and Details
More data for this
Ligand-Target Pair
Dihydroorotate Dehydrogenase (DHODH)


(Plasmodium berghei)
BDBM24412
PNG
(5-methyl-N-phenyl-[1,2,4]triazolo[1,5-a]pyrimidin-...)
Show SMILES Cc1cc(Nc2ccccc2)n2ncnc2n1
Show InChI InChI=1S/C12H11N5/c1-9-7-11(16-10-5-3-2-4-6-10)17-12(15-9)13-8-14-17/h2-8,16H,1H3
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n/an/a>1.00E+4n/an/an/an/a8.020



University of Washington at Seattle



Assay Description
The assays were carried out by using a colorimetric DCIP method, which uses the colorimetric reagent 2, 6-dichlorophenolindophenol as the final elect...


Citation and Details
More data for this
Ligand-Target Pair
Dihydroorotate Dehydrogenase (DHODH)


(Plasmodium berghei)
BDBM28833
PNG
(N-(3,4-difluorophenyl)-5-methyl-[1,2,4]triazolo[1,...)
Show SMILES Cc1cc(Nc2ccc(F)c(F)c2)n2ncnc2n1
Show InChI InChI=1S/C12H9F2N5/c1-7-4-11(19-12(17-7)15-6-16-19)18-8-2-3-9(13)10(14)5-8/h2-6,18H,1H3
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PubMed
n/an/a 1.00E+4n/an/an/an/a8.020



University of Washington at Seattle



Assay Description
The assays were carried out by using a colorimetric DCIP method, which uses the colorimetric reagent 2, 6-dichlorophenolindophenol as the final elect...


Citation and Details
More data for this
Ligand-Target Pair
Dihydroorotate Dehydrogenase (DHODH)


(Plasmodium berghei)
BDBM120364
PNG
(US8703811, 4)
Show SMILES Fc1cc(I)ccc1Nc1ccnc2cc(Cl)ccc12
Show InChI InChI=1S/C15H9ClFIN2/c16-9-1-3-11-13(5-6-19-15(11)7-9)20-14-4-2-10(18)8-12(14)17/h1-8H,(H,19,20)
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US Patent
n/an/a>1.00E+4n/an/an/an/an/an/a



Genzyme Corporation; Massachusetts Institute of Technology; President and Fellows of Harvard College

US Patent


Assay Description
Type 2 DHODH activity was monitored with either the direct assay measuring the formation of orotate or via a chromogen reduction assay using DCIP. Al...


US Patent US8703811 (2014)

More data for this
Ligand-Target Pair
Dihydroorotate Dehydrogenase (DHODH)


(Plasmodium berghei)
BDBM28841
PNG
(4-({5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl}...)
Show SMILES Cc1cc(Nc2ccc(C#N)c(c2)C(F)(F)F)n2ncnc2n1
Show InChI InChI=1S/C14H9F3N6/c1-8-4-12(23-13(21-8)19-7-20-23)22-10-3-2-9(6-18)11(5-10)14(15,16)17/h2-5,7,22H,1H3
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n/an/a 1.10E+4n/an/an/an/a8.020



University of Washington at Seattle



Assay Description
The assays were carried out by using a colorimetric DCIP method, which uses the colorimetric reagent 2, 6-dichlorophenolindophenol as the final elect...


Citation and Details
More data for this
Ligand-Target Pair
Dihydroorotate Dehydrogenase (DHODH)


(Plasmodium berghei)
BDBM28816
PNG
(5-methyl-N-(4-methylphenyl)-[1,2,4]triazolo[1,5-a]...)
Show SMILES Cc1ccc(Nc2cc(C)nc3ncnn23)cc1
Show InChI InChI=1S/C13H13N5/c1-9-3-5-11(6-4-9)17-12-7-10(2)16-13-14-8-15-18(12)13/h3-8,17H,1-2H3
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PubMed
n/an/a 1.60E+4n/an/an/an/a8.020



University of Washington at Seattle



Assay Description
The assays were carried out by using a colorimetric DCIP method, which uses the colorimetric reagent 2, 6-dichlorophenolindophenol as the final elect...


Citation and Details
More data for this
Ligand-Target Pair
Dihydroorotate Dehydrogenase (DHODH)


(Plasmodium berghei)
BDBM28836
PNG
(N-(4-fluoro-3-methylphenyl)-5-methyl-[1,2,4]triazo...)
Show SMILES Cc1cc(Nc2ccc(F)c(C)c2)n2ncnc2n1
Show InChI InChI=1S/C13H12FN5/c1-8-5-10(3-4-11(8)14)18-12-6-9(2)17-13-15-7-16-19(12)13/h3-7,18H,1-2H3
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PubMed
n/an/a 2.10E+4n/an/an/an/a8.020



University of Washington at Seattle



Assay Description
The assays were carried out by using a colorimetric DCIP method, which uses the colorimetric reagent 2, 6-dichlorophenolindophenol as the final elect...


Citation and Details
More data for this
Ligand-Target Pair
Dihydroorotate Dehydrogenase (DHODH)


(Plasmodium berghei)
BDBM28834
PNG
(N-(3,5-difluorophenyl)-5-methyl-[1,2,4]triazolo[1,...)
Show SMILES Cc1cc(Nc2cc(F)cc(F)c2)n2ncnc2n1
Show InChI InChI=1S/C12H9F2N5/c1-7-2-11(19-12(17-7)15-6-16-19)18-10-4-8(13)3-9(14)5-10/h2-6,18H,1H3
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n/an/a 2.10E+4n/an/an/an/a8.020



University of Washington at Seattle



Assay Description
The assays were carried out by using a colorimetric DCIP method, which uses the colorimetric reagent 2, 6-dichlorophenolindophenol as the final elect...


Citation and Details
More data for this
Ligand-Target Pair
Dihydroorotate Dehydrogenase (DHODH)


(Plasmodium berghei)
BDBM28820
PNG
(N-[4-(difluoromethoxy)phenyl]-5-methyl-[1,2,4]tria...)
Show SMILES Cc1cc(Nc2ccc(OC(F)F)cc2)n2ncnc2n1
Show InChI InChI=1S/C13H11F2N5O/c1-8-6-11(20-13(18-8)16-7-17-20)19-9-2-4-10(5-3-9)21-12(14)15/h2-7,12,19H,1H3
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n/an/a 2.50E+4n/an/an/an/a8.020



University of Washington at Seattle



Assay Description
The assays were carried out by using a colorimetric DCIP method, which uses the colorimetric reagent 2, 6-dichlorophenolindophenol as the final elect...


Citation and Details
More data for this
Ligand-Target Pair
Dihydroorotate Dehydrogenase (DHODH)


(Plasmodium berghei)
BDBM28810
PNG
(N-(3-chlorophenyl)-5-methyl-[1,2,4]triazolo[1,5-a]...)
Show SMILES Cc1cc(Nc2cccc(Cl)c2)n2ncnc2n1
Show InChI InChI=1S/C12H10ClN5/c1-8-5-11(18-12(16-8)14-7-15-18)17-10-4-2-3-9(13)6-10/h2-7,17H,1H3
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PubMed
n/an/a 3.10E+4n/an/an/an/a8.020



University of Washington at Seattle



Assay Description
The assays were carried out by using a colorimetric DCIP method, which uses the colorimetric reagent 2, 6-dichlorophenolindophenol as the final elect...


Citation and Details
More data for this
Ligand-Target Pair
Dihydroorotate Dehydrogenase (DHODH)


(Plasmodium berghei)
BDBM28818
PNG
(N-(4-methoxyphenyl)-5-methyl-[1,2,4]triazolo[1,5-a...)
Show SMILES COc1ccc(Nc2cc(C)nc3ncnn23)cc1
Show InChI InChI=1S/C13H13N5O/c1-9-7-12(18-13(16-9)14-8-15-18)17-10-3-5-11(19-2)6-4-10/h3-8,17H,1-2H3
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n/an/a>5.00E+4n/an/an/an/a8.020



University of Washington at Seattle



Assay Description
The assays were carried out by using a colorimetric DCIP method, which uses the colorimetric reagent 2, 6-dichlorophenolindophenol as the final elect...


Citation and Details
More data for this
Ligand-Target Pair
Dihydroorotate Dehydrogenase (DHODH)


(Plasmodium berghei)
BDBM28812
PNG
(5-methyl-N-[3-(trifluoromethyl)phenyl]-[1,2,4]tria...)
Show SMILES Cc1cc(Nc2cccc(c2)C(F)(F)F)n2ncnc2n1
Show InChI InChI=1S/C13H10F3N5/c1-8-5-11(21-12(19-8)17-7-18-21)20-10-4-2-3-9(6-10)13(14,15)16/h2-7,20H,1H3
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n/an/a 5.50E+4n/an/an/an/a8.020



University of Washington at Seattle



Assay Description
The assays were carried out by using a colorimetric DCIP method, which uses the colorimetric reagent 2, 6-dichlorophenolindophenol as the final elect...


Citation and Details
More data for this
Ligand-Target Pair
Dihydroorotate Dehydrogenase (DHODH)


(Plasmodium berghei)
BDBM28829
PNG
(5-methyl-N-(2,4,6-trifluorophenyl)-[1,2,4]triazolo...)
Show SMILES Cc1cc(Nc2c(F)cc(F)cc2F)n2ncnc2n1
Show InChI InChI=1S/C12H8F3N5/c1-6-2-10(20-12(18-6)16-5-17-20)19-11-8(14)3-7(13)4-9(11)15/h2-5,19H,1H3
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n/an/a>1.00E+5n/an/an/an/a8.020



University of Washington at Seattle



Assay Description
The assays were carried out by using a colorimetric DCIP method, which uses the colorimetric reagent 2, 6-dichlorophenolindophenol as the final elect...


Citation and Details
More data for this
Ligand-Target Pair
Dihydroorotate Dehydrogenase (DHODH)


(Plasmodium berghei)
BDBM28823
PNG
(N-(4-benzylphenyl)-5-methyl-[1,2,4]triazolo[1,5-a]...)
Show SMILES Cc1cc(Nc2ccc(Cc3ccccc3)cc2)n2ncnc2n1
Show InChI InChI=1S/C19H17N5/c1-14-11-18(24-19(22-14)20-13-21-24)23-17-9-7-16(8-10-17)12-15-5-3-2-4-6-15/h2-11,13,23H,12H2,1H3
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n/an/a>1.00E+5n/an/an/an/a8.020



University of Washington at Seattle



Assay Description
The assays were carried out by using a colorimetric DCIP method, which uses the colorimetric reagent 2, 6-dichlorophenolindophenol as the final elect...


Citation and Details
More data for this
Ligand-Target Pair
Dihydroorotate Dehydrogenase (DHODH)


(Plasmodium berghei)
BDBM28808
PNG
(2-({5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl}...)
Show SMILES Cc1cc(Nc2ccccc2C#N)n2ncnc2n1
Show InChI InChI=1S/C13H10N6/c1-9-6-12(19-13(17-9)15-8-16-19)18-11-5-3-2-4-10(11)7-14/h2-6,8,18H,1H3
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n/an/a>1.00E+5n/an/an/an/a8.020



University of Washington at Seattle



Assay Description
The assays were carried out by using a colorimetric DCIP method, which uses the colorimetric reagent 2, 6-dichlorophenolindophenol as the final elect...


Citation and Details
More data for this
Ligand-Target Pair
Dihydroorotate Dehydrogenase (DHODH)


(Plasmodium berghei)
BDBM28807
PNG
(5-methyl-N-[2-(trifluoromethyl)phenyl]-[1,2,4]tria...)
Show SMILES Cc1cc(Nc2ccccc2C(F)(F)F)n2ncnc2n1
Show InChI InChI=1S/C13H10F3N5/c1-8-6-11(21-12(19-8)17-7-18-21)20-10-5-3-2-4-9(10)13(14,15)16/h2-7,20H,1H3
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n/an/a>1.00E+5n/an/an/an/a8.020



University of Washington at Seattle



Assay Description
The assays were carried out by using a colorimetric DCIP method, which uses the colorimetric reagent 2, 6-dichlorophenolindophenol as the final elect...


Citation and Details
More data for this
Ligand-Target Pair
Dihydroorotate Dehydrogenase (DHODH)


(Plasmodium berghei)
BDBM28804
PNG
(N-(2-fluorophenyl)-5-methyl-[1,2,4]triazolo[1,5-a]...)
Show SMILES Cc1cc(Nc2ccccc2F)n2ncnc2n1
Show InChI InChI=1S/C12H10FN5/c1-8-6-11(18-12(16-8)14-7-15-18)17-10-5-3-2-4-9(10)13/h2-7,17H,1H3
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n/an/a>1.00E+5n/an/an/an/a8.020



University of Washington at Seattle



Assay Description
The assays were carried out by using a colorimetric DCIP method, which uses the colorimetric reagent 2, 6-dichlorophenolindophenol as the final elect...


Citation and Details
More data for this
Ligand-Target Pair
Dihydroorotate Dehydrogenase (DHODH)


(Plasmodium berghei)
BDBM28832
PNG
(N-(2-fluoro-4-methylphenyl)-5-methyl-[1,2,4]triazo...)
Show SMILES Cc1ccc(Nc2cc(C)nc3ncnn23)c(F)c1
Show InChI InChI=1S/C13H12FN5/c1-8-3-4-11(10(14)5-8)18-12-6-9(2)17-13-15-7-16-19(12)13/h3-7,18H,1-2H3
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n/an/a>1.00E+5n/an/an/an/a8.020



University of Washington at Seattle



Assay Description
The assays were carried out by using a colorimetric DCIP method, which uses the colorimetric reagent 2, 6-dichlorophenolindophenol as the final elect...


Citation and Details
More data for this
Ligand-Target Pair
Dihydroorotate Dehydrogenase (DHODH)


(Plasmodium berghei)
BDBM28806
PNG
(5-methyl-N-(2-methylphenyl)-[1,2,4]triazolo[1,5-a]...)
Show SMILES Cc1cc(Nc2ccccc2C)n2ncnc2n1
Show InChI InChI=1S/C13H13N5/c1-9-5-3-4-6-11(9)17-12-7-10(2)16-13-14-8-15-18(12)13/h3-8,17H,1-2H3
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n/an/a>1.00E+5n/an/an/an/a8.020



University of Washington at Seattle



Assay Description
The assays were carried out by using a colorimetric DCIP method, which uses the colorimetric reagent 2, 6-dichlorophenolindophenol as the final elect...


Citation and Details
More data for this
Ligand-Target Pair
Dihydroorotate Dehydrogenase (DHODH)


(Plasmodium berghei)
BDBM28831
PNG
(5-methyl-N-(2,3,4,5,6-pentafluorophenyl)-[1,2,4]tr...)
Show SMILES Cc1cc(Nc2c(F)c(F)c(F)c(F)c2F)n2ncnc2n1
Show InChI InChI=1S/C12H6F5N5/c1-4-2-5(22-12(20-4)18-3-19-22)21-11-9(16)7(14)6(13)8(15)10(11)17/h2-3,21H,1H3
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n/an/a>1.00E+5n/an/an/an/a8.020



University of Washington at Seattle



Assay Description
The assays were carried out by using a colorimetric DCIP method, which uses the colorimetric reagent 2, 6-dichlorophenolindophenol as the final elect...


Citation and Details
More data for this
Ligand-Target Pair
Dihydroorotate Dehydrogenase (DHODH)


(Plasmodium berghei)
BDBM28809
PNG
(N-(3-fluorophenyl)-5-methyl-[1,2,4]triazolo[1,5-a]...)
Show SMILES Cc1cc(Nc2cccc(F)c2)n2ncnc2n1
Show InChI InChI=1S/C12H10FN5/c1-8-5-11(18-12(16-8)14-7-15-18)17-10-4-2-3-9(13)6-10/h2-7,17H,1H3
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n/an/a>1.00E+5n/an/an/an/a8.020



University of Washington at Seattle



Assay Description
The assays were carried out by using a colorimetric DCIP method, which uses the colorimetric reagent 2, 6-dichlorophenolindophenol as the final elect...


Citation and Details
More data for this
Ligand-Target Pair
Dihydroorotate Dehydrogenase (DHODH)


(Plasmodium berghei)
BDBM28813
PNG
(N-(4-fluorophenyl)-5-methyl-[1,2,4]triazolo[1,5-a]...)
Show SMILES Cc1cc(Nc2ccc(F)cc2)n2ncnc2n1
Show InChI InChI=1S/C12H10FN5/c1-8-6-11(18-12(16-8)14-7-15-18)17-10-4-2-9(13)3-5-10/h2-7,17H,1H3
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n/an/a>1.00E+5n/an/an/an/a8.020



University of Washington at Seattle



Assay Description
The assays were carried out by using a colorimetric DCIP method, which uses the colorimetric reagent 2, 6-dichlorophenolindophenol as the final elect...


Citation and Details
More data for this
Ligand-Target Pair
Dihydroorotate Dehydrogenase (DHODH)


(Plasmodium berghei)
BDBM28811
PNG
(5-methyl-N-(3-methylphenyl)-[1,2,4]triazolo[1,5-a]...)
Show SMILES Cc1cccc(Nc2cc(C)nc3ncnn23)c1
Show InChI InChI=1S/C13H13N5/c1-9-4-3-5-11(6-9)17-12-7-10(2)16-13-14-8-15-18(12)13/h3-8,17H,1-2H3
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n/an/a>1.00E+5n/an/an/an/a8.020



University of Washington at Seattle



Assay Description
The assays were carried out by using a colorimetric DCIP method, which uses the colorimetric reagent 2, 6-dichlorophenolindophenol as the final elect...


Citation and Details
More data for this
Ligand-Target Pair
Dihydroorotate Dehydrogenase (DHODH)


(Plasmodium berghei)
BDBM28805
PNG
(N-(2-chlorophenyl)-5-methyl-[1,2,4]triazolo[1,5-a]...)
Show SMILES Cc1cc(Nc2ccccc2Cl)n2ncnc2n1
Show InChI InChI=1S/C12H10ClN5/c1-8-6-11(18-12(16-8)14-7-15-18)17-10-5-3-2-4-9(10)13/h2-7,17H,1H3
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n/an/a>1.00E+5n/an/an/an/a8.020



University of Washington at Seattle



Assay Description
The assays were carried out by using a colorimetric DCIP method, which uses the colorimetric reagent 2, 6-dichlorophenolindophenol as the final elect...


Citation and Details
More data for this
Ligand-Target Pair
Dihydroorotate Dehydrogenase (DHODH)


(Plasmodium berghei)
BDBM28835
PNG
(N-[3,5-bis(trifluoromethyl)phenyl]-5-methyl-[1,2,4...)
Show SMILES Cc1cc(Nc2cc(cc(c2)C(F)(F)F)C(F)(F)F)n2ncnc2n1
Show InChI InChI=1S/C14H9F6N5/c1-7-2-11(25-12(23-7)21-6-22-25)24-10-4-8(13(15,16)17)3-9(5-10)14(18,19)20/h2-6,24H,1H3
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n/an/a>1.00E+5n/an/an/an/a8.020



University of Washington at Seattle



Assay Description
The assays were carried out by using a colorimetric DCIP method, which uses the colorimetric reagent 2, 6-dichlorophenolindophenol as the final elect...


Citation and Details
More data for this
Ligand-Target Pair
Dihydroorotate Dehydrogenase (DHODH)


(Plasmodium berghei)
BDBM28825
PNG
(N-(2,5-difluorophenyl)-5-methyl-[1,2,4]triazolo[1,...)
Show SMILES Cc1cc(Nc2cc(F)ccc2F)n2ncnc2n1
Show InChI InChI=1S/C12H9F2N5/c1-7-4-11(19-12(17-7)15-6-16-19)18-10-5-8(13)2-3-9(10)14/h2-6,18H,1H3
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n/an/a>1.00E+5n/an/an/an/a8.020



University of Washington at Seattle



Assay Description
The assays were carried out by using a colorimetric DCIP method, which uses the colorimetric reagent 2, 6-dichlorophenolindophenol as the final elect...


Citation and Details
More data for this
Ligand-Target Pair
Dihydroorotate Dehydrogenase (DHODH)


(Plasmodium berghei)
BDBM28830
PNG
(5-methyl-N-(2,3,5,6-tetrafluorophenyl)-[1,2,4]tria...)
Show SMILES Cc1cc(Nc2c(F)c(F)cc(F)c2F)n2ncnc2n1
Show InChI InChI=1S/C12H7F4N5/c1-5-2-8(21-12(19-5)17-4-18-21)20-11-9(15)6(13)3-7(14)10(11)16/h2-4,20H,1H3
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n/an/a>1.00E+5n/an/an/an/a8.020



University of Washington at Seattle



Assay Description
The assays were carried out by using a colorimetric DCIP method, which uses the colorimetric reagent 2, 6-dichlorophenolindophenol as the final elect...


Citation and Details
More data for this
Ligand-Target Pair
Dihydroorotate Dehydrogenase (DHODH)


(Plasmodium berghei)
BDBM28828
PNG
(5-methyl-N-(2,4,5-trifluorophenyl)-[1,2,4]triazolo...)
Show SMILES Cc1cc(Nc2cc(F)c(F)cc2F)n2ncnc2n1
Show InChI InChI=1S/C12H8F3N5/c1-6-2-11(20-12(18-6)16-5-17-20)19-10-4-8(14)7(13)3-9(10)15/h2-5,19H,1H3
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UniProtKB/TrEMBL

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UniChem

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Article
PubMed
n/an/a>1.00E+5n/an/an/an/a8.020



University of Washington at Seattle



Assay Description
The assays were carried out by using a colorimetric DCIP method, which uses the colorimetric reagent 2, 6-dichlorophenolindophenol as the final elect...


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