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PubMed code 9873513

Compile data set for download or QSAR
Found 27 hits of Enzyme Inhibition Constant Data   
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
Dihydroorotate dehydrogenase


(Homo sapiens (Human))
BDBM14712
PNG
((2Z)-2-cyano-3-hydroxy-N-[4-(trifluoromethyl)pheny...)
Show SMILES CC(=O)C(C#N)C(=O)Nc1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C12H9F3N2O2/c1-7(18)10(6-16)11(19)17-9-4-2-8(3-5-9)12(13,14)15/h2-5,10H,1H3,(H,17,19)
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n/an/a 200n/an/an/an/an/an/a



Novartis Pharma AG

Curated by ChEMBL


Assay Description
Immunosuppressive activity of the compound expressed as ability to inhibit human recombinant dihydroorotate dehydrogenase (DHODH)


Bioorg Med Chem Lett 8: 2203-8 (1999)


Article DOI: 10.1016/s0960-894x(98)00365-5
BindingDB Entry DOI: 10.7270/Q2QN65X4
More data for this
Ligand-Target Pair
Dihydroorotate dehydrogenase


(Homo sapiens (Human))
BDBM50071393
PNG
(5-Ethyl-isoxazole-4-carbothioic acid (4-trifluorom...)
Show SMILES CCc1oncc1C(=S)Nc1ccc(OC(F)(F)F)cc1
Show InChI InChI=1S/C13H11F3N2O2S/c1-2-11-10(7-17-20-11)12(21)18-8-3-5-9(6-4-8)19-13(14,15)16/h3-7H,2H2,1H3,(H,18,21)
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n/an/a 700n/an/an/an/an/an/a



Novartis Pharma AG

Curated by ChEMBL


Assay Description
Immunosuppressive activity of the compound expressed as ability to inhibit human recombinant dihydroorotate dehydrogenase (DHODH)


Bioorg Med Chem Lett 8: 2203-8 (1999)


Article DOI: 10.1016/s0960-894x(98)00365-5
BindingDB Entry DOI: 10.7270/Q2QN65X4
More data for this
Ligand-Target Pair
Dihydroorotate dehydrogenase


(Homo sapiens (Human))
BDBM50071392
PNG
((E)-2-Cyano-3-hydroxy-but-2-enethioic acid (4-trif...)
Show SMILES CC(=O)C(C#N)C(=S)Nc1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C12H9F3N2OS/c1-7(18)10(6-16)11(19)17-9-4-2-8(3-5-9)12(13,14)15/h2-5,10H,1H3,(H,17,19)
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n/an/a 800n/an/an/an/an/an/a



Novartis Pharma AG

Curated by ChEMBL


Assay Description
Immunosuppressive activity of the compound expressed as ability to inhibit human recombinant dihydroorotate dehydrogenase (DHODH)


Bioorg Med Chem Lett 8: 2203-8 (1999)


Article DOI: 10.1016/s0960-894x(98)00365-5
BindingDB Entry DOI: 10.7270/Q2QN65X4
More data for this
Ligand-Target Pair
Dihydroorotate dehydrogenase


(Homo sapiens (Human))
BDBM50071387
PNG
(5-Cyclopropyl-isoxazole-4-carbothioic acid (4-trif...)
Show SMILES FC(F)(F)Oc1ccc(NC(=S)c2cnoc2C2CC2)cc1
Show InChI InChI=1S/C14H11F3N2O2S/c15-14(16,17)20-10-5-3-9(4-6-10)19-13(22)11-7-18-21-12(11)8-1-2-8/h3-8H,1-2H2,(H,19,22)
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n/an/a 800n/an/an/an/an/an/a



Novartis Pharma AG

Curated by ChEMBL


Assay Description
Immunosuppressive activity of the compound expressed as ability to inhibit human recombinant dihydroorotate dehydrogenase (DHODH)


Bioorg Med Chem Lett 8: 2203-8 (1999)


Article DOI: 10.1016/s0960-894x(98)00365-5
BindingDB Entry DOI: 10.7270/Q2QN65X4
More data for this
Ligand-Target Pair
Dihydroorotate dehydrogenase


(Homo sapiens (Human))
BDBM50071403
PNG
(5-Ethyl-isoxazole-4-carbothioic acid (4-trifluorom...)
Show SMILES CCc1oncc1C(=S)Nc1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C13H11F3N2OS/c1-2-11-10(7-17-19-11)12(20)18-9-5-3-8(4-6-9)13(14,15)16/h3-7H,2H2,1H3,(H,18,20)
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n/an/a 3.00E+3n/an/an/an/an/an/a



Novartis Pharma AG

Curated by ChEMBL


Assay Description
Immunosuppressive activity of the compound expressed as ability to inhibit human recombinant dihydroorotate dehydrogenase (DHODH)


Bioorg Med Chem Lett 8: 2203-8 (1999)


Article DOI: 10.1016/s0960-894x(98)00365-5
BindingDB Entry DOI: 10.7270/Q2QN65X4
More data for this
Ligand-Target Pair
Dihydroorotate dehydrogenase


(Homo sapiens (Human))
BDBM50071394
PNG
(5-Cyclopropyl-isoxazole-4-carbothioic acid (4-trif...)
Show SMILES FC(F)(F)c1ccc(NC(=S)c2cnoc2C2CC2)cc1
Show InChI InChI=1S/C14H11F3N2OS/c15-14(16,17)9-3-5-10(6-4-9)19-13(21)11-7-18-20-12(11)8-1-2-8/h3-8H,1-2H2,(H,19,21)
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n/an/a 3.20E+3n/an/an/an/an/an/a



Novartis Pharma AG

Curated by ChEMBL


Assay Description
Immunosuppressive activity of the compound expressed as ability to inhibit human recombinant dihydroorotate dehydrogenase (DHODH)


Bioorg Med Chem Lett 8: 2203-8 (1999)


Article DOI: 10.1016/s0960-894x(98)00365-5
BindingDB Entry DOI: 10.7270/Q2QN65X4
More data for this
Ligand-Target Pair
Dihydroorotate dehydrogenase


(Homo sapiens (Human))
BDBM50071396
PNG
(5-Methyl-isoxazole-4-carbothioic acid (4-trifluoro...)
Show SMILES Cc1oncc1C(=S)Nc1ccc(OC(F)(F)F)cc1
Show InChI InChI=1S/C12H9F3N2O2S/c1-7-10(6-16-19-7)11(20)17-8-2-4-9(5-3-8)18-12(13,14)15/h2-6H,1H3,(H,17,20)
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n/an/a 7.20E+3n/an/an/an/an/an/a



Novartis Pharma AG

Curated by ChEMBL


Assay Description
Immunosuppressive activity of the compound expressed as ability to inhibit human recombinant dihydroorotate dehydrogenase (DHODH)


Bioorg Med Chem Lett 8: 2203-8 (1999)


Article DOI: 10.1016/s0960-894x(98)00365-5
BindingDB Entry DOI: 10.7270/Q2QN65X4
More data for this
Ligand-Target Pair
Dihydroorotate dehydrogenase


(Homo sapiens (Human))
BDBM50071398
PNG
(5-Cyclopropyl-isoxazole-4-carbothioic acid (4-cyan...)
Show SMILES S=C(Nc1ccc(cc1)C#N)c1cnoc1C1CC1
Show InChI InChI=1S/C14H11N3OS/c15-7-9-1-5-11(6-2-9)17-14(19)12-8-16-18-13(12)10-3-4-10/h1-2,5-6,8,10H,3-4H2,(H,17,19)
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n/an/a 9.30E+3n/an/an/an/an/an/a



Novartis Pharma AG

Curated by ChEMBL


Assay Description
Immunosuppressive activity of the compound expressed as ability to inhibit human recombinant dihydroorotate dehydrogenase (DHODH)


Bioorg Med Chem Lett 8: 2203-8 (1999)


Article DOI: 10.1016/s0960-894x(98)00365-5
BindingDB Entry DOI: 10.7270/Q2QN65X4
More data for this
Ligand-Target Pair
Dihydroorotate dehydrogenase


(Homo sapiens (Human))
BDBM50054601
PNG
(5-Methyl-N-(4-(trifluoromethyl)phenyl)-4-isoxazole...)
Show SMILES Cc1oncc1C(=O)Nc1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C12H9F3N2O2/c1-7-10(6-16-19-7)11(18)17-9-4-2-8(3-5-9)12(13,14)15/h2-6H,1H3,(H,17,18)
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n/an/a 1.00E+4n/an/an/an/an/an/a



Novartis Pharma AG

Curated by ChEMBL


Assay Description
Immunosuppressive activity of the compound expressed as ability to inhibit human recombinant dihydroorotate dehydrogenase (DHODH)


Bioorg Med Chem Lett 8: 2203-8 (1999)


Article DOI: 10.1016/s0960-894x(98)00365-5
BindingDB Entry DOI: 10.7270/Q2QN65X4
More data for this
Ligand-Target Pair
Dihydroorotate dehydrogenase


(Homo sapiens (Human))
BDBM50071401
PNG
(5-Ethyl-isoxazole-4-carbothioic acid (4-cyano-phen...)
Show SMILES CCc1oncc1C(=S)Nc1ccc(cc1)C#N
Show InChI InChI=1S/C13H11N3OS/c1-2-12-11(8-15-17-12)13(18)16-10-5-3-9(7-14)4-6-10/h3-6,8H,2H2,1H3,(H,16,18)
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n/an/a 1.10E+4n/an/an/an/an/an/a



Novartis Pharma AG

Curated by ChEMBL


Assay Description
Immunosuppressive activity of the compound expressed as ability to inhibit human recombinant dihydroorotate dehydrogenase (DHODH)


Bioorg Med Chem Lett 8: 2203-8 (1999)


Article DOI: 10.1016/s0960-894x(98)00365-5
BindingDB Entry DOI: 10.7270/Q2QN65X4
More data for this
Ligand-Target Pair
Dihydroorotate dehydrogenase


(Homo sapiens (Human))
BDBM50071400
PNG
(5-Methyl-isoxazole-4-carbothioic acid (4-cyano-phe...)
Show SMILES Cc1oncc1C(=S)Nc1ccc(cc1)C#N
Show InChI InChI=1S/C12H9N3OS/c1-8-11(7-14-16-8)12(17)15-10-4-2-9(6-13)3-5-10/h2-5,7H,1H3,(H,15,17)
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n/an/a 3.50E+4n/an/an/an/an/an/a



Novartis Pharma AG

Curated by ChEMBL


Assay Description
Immunosuppressive activity of the compound expressed as ability to inhibit human recombinant dihydroorotate dehydrogenase (DHODH)


Bioorg Med Chem Lett 8: 2203-8 (1999)


Article DOI: 10.1016/s0960-894x(98)00365-5
BindingDB Entry DOI: 10.7270/Q2QN65X4
More data for this
Ligand-Target Pair
Dihydroorotate dehydrogenase


(Homo sapiens (Human))
BDBM50071389
PNG
(5-Ethyl-isoxazole-4-carbothioic acid (4-dimethylam...)
Show SMILES CCc1oncc1C(=S)Nc1ccc(cc1)N(C)C
Show InChI InChI=1S/C14H17N3OS/c1-4-13-12(9-15-18-13)14(19)16-10-5-7-11(8-6-10)17(2)3/h5-9H,4H2,1-3H3,(H,16,19)
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n/an/a 4.04E+4n/an/an/an/an/an/a



Novartis Pharma AG

Curated by ChEMBL


Assay Description
Immunosuppressive activity of the compound expressed as ability to inhibit human recombinant dihydroorotate dehydrogenase (DHODH)


Bioorg Med Chem Lett 8: 2203-8 (1999)


Article DOI: 10.1016/s0960-894x(98)00365-5
BindingDB Entry DOI: 10.7270/Q2QN65X4
More data for this
Ligand-Target Pair
Dihydroorotate dehydrogenase


(Homo sapiens (Human))
BDBM50071409
PNG
(5-tert-Butyl-isoxazole-4-carbothioic acid (4-dimet...)
Show SMILES CN(C)c1ccc(NC(=S)c2cnoc2C(C)(C)C)cc1
Show InChI InChI=1S/C16H21N3OS/c1-16(2,3)14-13(10-17-20-14)15(21)18-11-6-8-12(9-7-11)19(4)5/h6-10H,1-5H3,(H,18,21)
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n/an/a>5.00E+4n/an/an/an/an/an/a



Novartis Pharma AG

Curated by ChEMBL


Assay Description
Immunosuppressive activity of the compound expressed as ability to inhibit human recombinant dihydroorotate dehydrogenase (DHODH)


Bioorg Med Chem Lett 8: 2203-8 (1999)


Article DOI: 10.1016/s0960-894x(98)00365-5
BindingDB Entry DOI: 10.7270/Q2QN65X4
More data for this
Ligand-Target Pair
Dihydroorotate dehydrogenase


(Homo sapiens (Human))
BDBM50071390
PNG
(5-tert-Butyl-isoxazole-4-carbothioic acid (4-cyano...)
Show SMILES CC(C)(C)c1oncc1C(=S)Nc1ccc(cc1)C#N
Show InChI InChI=1S/C15H15N3OS/c1-15(2,3)13-12(9-17-19-13)14(20)18-11-6-4-10(8-16)5-7-11/h4-7,9H,1-3H3,(H,18,20)
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n/an/a>5.00E+4n/an/an/an/an/an/a



Novartis Pharma AG

Curated by ChEMBL


Assay Description
Immunosuppressive activity of the compound expressed as ability to inhibit human recombinant dihydroorotate dehydrogenase (DHODH)


Bioorg Med Chem Lett 8: 2203-8 (1999)


Article DOI: 10.1016/s0960-894x(98)00365-5
BindingDB Entry DOI: 10.7270/Q2QN65X4
More data for this
Ligand-Target Pair
Dihydroorotate dehydrogenase


(Homo sapiens (Human))
BDBM50071408
PNG
(5-Hexyl-isoxazole-4-carbothioic acid (4-trifluorom...)
Show SMILES CCCCCCc1oncc1C(=S)Nc1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C17H19F3N2OS/c1-2-3-4-5-6-15-14(11-21-23-15)16(24)22-13-9-7-12(8-10-13)17(18,19)20/h7-11H,2-6H2,1H3,(H,22,24)
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n/an/a>5.00E+4n/an/an/an/an/an/a



Novartis Pharma AG

Curated by ChEMBL


Assay Description
Immunosuppressive activity of the compound expressed as ability to inhibit human recombinant dihydroorotate dehydrogenase (DHODH)


Bioorg Med Chem Lett 8: 2203-8 (1999)


Article DOI: 10.1016/s0960-894x(98)00365-5
BindingDB Entry DOI: 10.7270/Q2QN65X4
More data for this
Ligand-Target Pair
Dihydroorotate dehydrogenase


(Homo sapiens (Human))
BDBM50071386
PNG
(5-Cyclohexyl-isoxazole-4-carbothioic acid (4-dimet...)
Show SMILES CN(C)c1ccc(NC(=S)c2cnoc2C2CCCCC2)cc1
Show InChI InChI=1S/C18H23N3OS/c1-21(2)15-10-8-14(9-11-15)20-18(23)16-12-19-22-17(16)13-6-4-3-5-7-13/h8-13H,3-7H2,1-2H3,(H,20,23)
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Novartis Pharma AG

Curated by ChEMBL


Assay Description
Immunosuppressive activity of the compound expressed as ability to inhibit human recombinant dihydroorotate dehydrogenase (DHODH)


Bioorg Med Chem Lett 8: 2203-8 (1999)


Article DOI: 10.1016/s0960-894x(98)00365-5
BindingDB Entry DOI: 10.7270/Q2QN65X4
More data for this
Ligand-Target Pair
Dihydroorotate dehydrogenase


(Homo sapiens (Human))
BDBM50071410
PNG
(5-Hexyl-isoxazole-4-carbothioic acid (4-dimethylam...)
Show SMILES CCCCCCc1oncc1C(=S)Nc1ccc(cc1)N(C)C
Show InChI InChI=1S/C18H25N3OS/c1-4-5-6-7-8-17-16(13-19-22-17)18(23)20-14-9-11-15(12-10-14)21(2)3/h9-13H,4-8H2,1-3H3,(H,20,23)
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n/an/a>5.00E+4n/an/an/an/an/an/a



Novartis Pharma AG

Curated by ChEMBL


Assay Description
Immunosuppressive activity of the compound expressed as ability to inhibit human recombinant dihydroorotate dehydrogenase (DHODH)


Bioorg Med Chem Lett 8: 2203-8 (1999)


Article DOI: 10.1016/s0960-894x(98)00365-5
BindingDB Entry DOI: 10.7270/Q2QN65X4
More data for this
Ligand-Target Pair
Dihydroorotate dehydrogenase


(Homo sapiens (Human))
BDBM50071399
PNG
(5-Cyclohexyl-isoxazole-4-carbothioic acid (4-trifl...)
Show SMILES FC(F)(F)c1ccc(NC(=S)c2cnoc2C2CCCCC2)cc1
Show InChI InChI=1S/C17H17F3N2OS/c18-17(19,20)12-6-8-13(9-7-12)22-16(24)14-10-21-23-15(14)11-4-2-1-3-5-11/h6-11H,1-5H2,(H,22,24)
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n/an/a>5.00E+4n/an/an/an/an/an/a



Novartis Pharma AG

Curated by ChEMBL


Assay Description
Immunosuppressive activity of the compound expressed as ability to inhibit human recombinant dihydroorotate dehydrogenase (DHODH)


Bioorg Med Chem Lett 8: 2203-8 (1999)


Article DOI: 10.1016/s0960-894x(98)00365-5
BindingDB Entry DOI: 10.7270/Q2QN65X4
More data for this
Ligand-Target Pair
Dihydroorotate dehydrogenase


(Homo sapiens (Human))
BDBM50071404
PNG
(5-tert-Butyl-isoxazole-4-carbothioic acid (4-trifl...)
Show SMILES CC(C)(C)c1oncc1C(=S)Nc1ccc(OC(F)(F)F)cc1
Show InChI InChI=1S/C15H15F3N2O2S/c1-14(2,3)12-11(8-19-22-12)13(23)20-9-4-6-10(7-5-9)21-15(16,17)18/h4-8H,1-3H3,(H,20,23)
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n/an/a>5.00E+4n/an/an/an/an/an/a



Novartis Pharma AG

Curated by ChEMBL


Assay Description
Immunosuppressive activity of the compound expressed as ability to inhibit human recombinant dihydroorotate dehydrogenase (DHODH)


Bioorg Med Chem Lett 8: 2203-8 (1999)


Article DOI: 10.1016/s0960-894x(98)00365-5
BindingDB Entry DOI: 10.7270/Q2QN65X4
More data for this
Ligand-Target Pair
Dihydroorotate dehydrogenase


(Homo sapiens (Human))
BDBM50071397
PNG
(5-Hexyl-isoxazole-4-carbothioic acid (4-trifluorom...)
Show SMILES CCCCCCc1oncc1C(=S)Nc1ccc(OC(F)(F)F)cc1
Show InChI InChI=1S/C17H19F3N2O2S/c1-2-3-4-5-6-15-14(11-21-24-15)16(25)22-12-7-9-13(10-8-12)23-17(18,19)20/h7-11H,2-6H2,1H3,(H,22,25)
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n/an/a>5.00E+4n/an/an/an/an/an/a



Novartis Pharma AG

Curated by ChEMBL


Assay Description
Immunosuppressive activity of the compound expressed as ability to inhibit human recombinant dihydroorotate dehydrogenase (DHODH)


Bioorg Med Chem Lett 8: 2203-8 (1999)


Article DOI: 10.1016/s0960-894x(98)00365-5
BindingDB Entry DOI: 10.7270/Q2QN65X4
More data for this
Ligand-Target Pair
Dihydroorotate dehydrogenase


(Homo sapiens (Human))
BDBM50071391
PNG
(5-tert-Butyl-isoxazole-4-carbothioic acid (4-trifl...)
Show SMILES CC(C)(C)c1oncc1C(=S)Nc1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C15H15F3N2OS/c1-14(2,3)12-11(8-19-21-12)13(22)20-10-6-4-9(5-7-10)15(16,17)18/h4-8H,1-3H3,(H,20,22)
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PubMed
n/an/a>5.00E+4n/an/an/an/an/an/a



Novartis Pharma AG

Curated by ChEMBL


Assay Description
Immunosuppressive activity of the compound expressed as ability to inhibit human recombinant dihydroorotate dehydrogenase (DHODH)


Bioorg Med Chem Lett 8: 2203-8 (1999)


Article DOI: 10.1016/s0960-894x(98)00365-5
BindingDB Entry DOI: 10.7270/Q2QN65X4
More data for this
Ligand-Target Pair
Dihydroorotate dehydrogenase


(Homo sapiens (Human))
BDBM50071395
PNG
(5-Methyl-isoxazole-4-carbothioic acid (4-trifluoro...)
Show SMILES Cc1oncc1C(=S)Nc1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C12H9F3N2OS/c1-7-10(6-16-18-7)11(19)17-9-4-2-8(3-5-9)12(13,14)15/h2-6H,1H3,(H,17,19)
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Article
PubMed
n/an/a>5.00E+4n/an/an/an/an/an/a



Novartis Pharma AG

Curated by ChEMBL


Assay Description
Immunosuppressive activity of the compound expressed as ability to inhibit human recombinant dihydroorotate dehydrogenase (DHODH)


Bioorg Med Chem Lett 8: 2203-8 (1999)


Article DOI: 10.1016/s0960-894x(98)00365-5
BindingDB Entry DOI: 10.7270/Q2QN65X4
More data for this
Ligand-Target Pair
Dihydroorotate dehydrogenase


(Homo sapiens (Human))
BDBM50071402
PNG
(5-Cyclohexyl-isoxazole-4-carbothioic acid (4-cyano...)
Show SMILES S=C(Nc1ccc(cc1)C#N)c1cnoc1C1CCCCC1
Show InChI InChI=1S/C17H17N3OS/c18-10-12-6-8-14(9-7-12)20-17(22)15-11-19-21-16(15)13-4-2-1-3-5-13/h6-9,11,13H,1-5H2,(H,20,22)
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PubMed
n/an/a>5.00E+4n/an/an/an/an/an/a



Novartis Pharma AG

Curated by ChEMBL


Assay Description
Immunosuppressive activity of the compound expressed as ability to inhibit human recombinant dihydroorotate dehydrogenase (DHODH)


Bioorg Med Chem Lett 8: 2203-8 (1999)


Article DOI: 10.1016/s0960-894x(98)00365-5
BindingDB Entry DOI: 10.7270/Q2QN65X4
More data for this
Ligand-Target Pair
Dihydroorotate dehydrogenase


(Homo sapiens (Human))
BDBM50071388
PNG
(5-Hexyl-isoxazole-4-carbothioic acid (4-cyano-phen...)
Show SMILES CCCCCCc1oncc1C(=S)Nc1ccc(cc1)C#N
Show InChI InChI=1S/C17H19N3OS/c1-2-3-4-5-6-16-15(12-19-21-16)17(22)20-14-9-7-13(11-18)8-10-14/h7-10,12H,2-6H2,1H3,(H,20,22)
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n/an/a>5.00E+4n/an/an/an/an/an/a



Novartis Pharma AG

Curated by ChEMBL


Assay Description
Immunosuppressive activity of the compound expressed as ability to inhibit human recombinant dihydroorotate dehydrogenase (DHODH)


Bioorg Med Chem Lett 8: 2203-8 (1999)


Article DOI: 10.1016/s0960-894x(98)00365-5
BindingDB Entry DOI: 10.7270/Q2QN65X4
More data for this
Ligand-Target Pair
Dihydroorotate dehydrogenase


(Homo sapiens (Human))
BDBM50071385
PNG
(5-Cyclohexyl-isoxazole-4-carbothioic acid (4-trifl...)
Show SMILES FC(F)(F)Oc1ccc(NC(=S)c2cnoc2C2CCCCC2)cc1
Show InChI InChI=1S/C17H17F3N2O2S/c18-17(19,20)23-13-8-6-12(7-9-13)22-16(25)14-10-21-24-15(14)11-4-2-1-3-5-11/h6-11H,1-5H2,(H,22,25)
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n/an/a>5.00E+4n/an/an/an/an/an/a



Novartis Pharma AG

Curated by ChEMBL


Assay Description
Immunosuppressive activity of the compound expressed as ability to inhibit human recombinant dihydroorotate dehydrogenase (DHODH)


Bioorg Med Chem Lett 8: 2203-8 (1999)


Article DOI: 10.1016/s0960-894x(98)00365-5
BindingDB Entry DOI: 10.7270/Q2QN65X4
More data for this
Ligand-Target Pair
Dihydroorotate dehydrogenase


(Homo sapiens (Human))
BDBM50071407
PNG
(5-Cyclopropyl-isoxazole-4-carbothioic acid (4-dime...)
Show SMILES CN(C)c1ccc(NC(=S)c2cnoc2C2CC2)cc1
Show InChI InChI=1S/C15H17N3OS/c1-18(2)12-7-5-11(6-8-12)17-15(20)13-9-16-19-14(13)10-3-4-10/h5-10H,3-4H2,1-2H3,(H,17,20)
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PubMed
n/an/a>5.00E+4n/an/an/an/an/an/a



Novartis Pharma AG

Curated by ChEMBL


Assay Description
Immunosuppressive activity of the compound expressed as ability to inhibit human recombinant dihydroorotate dehydrogenase (DHODH)


Bioorg Med Chem Lett 8: 2203-8 (1999)


Article DOI: 10.1016/s0960-894x(98)00365-5
BindingDB Entry DOI: 10.7270/Q2QN65X4
More data for this
Ligand-Target Pair
Dihydroorotate dehydrogenase


(Homo sapiens (Human))
BDBM50071405
PNG
(5-Methyl-isoxazole-4-carbothioic acid (4-dimethyla...)
Show SMILES CN(C)c1ccc(NC(=S)c2cnoc2C)cc1
Show InChI InChI=1S/C13H15N3OS/c1-9-12(8-14-17-9)13(18)15-10-4-6-11(7-5-10)16(2)3/h4-8H,1-3H3,(H,15,18)
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n/an/a>5.00E+4n/an/an/an/an/an/a



Novartis Pharma AG

Curated by ChEMBL


Assay Description
Immunosuppressive activity of the compound expressed as ability to inhibit human recombinant dihydroorotate dehydrogenase (DHODH)


Bioorg Med Chem Lett 8: 2203-8 (1999)


Article DOI: 10.1016/s0960-894x(98)00365-5
BindingDB Entry DOI: 10.7270/Q2QN65X4
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%