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Compile Data Set for Download or QSAR

Found 27 hits Enz. Inhib. hit(s) with all data for assayid = 1 entry = 50008123   
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 (quinone), mitochondrial


(Homo sapiens (Human))
BDBM50070857
PNG
(CHEMBL50499 | Sodium; 6-fluoro-3-methyl-2-(4-pheny...)
Show SMILES Cc1c(nc2ccc(F)cc2c1C([O-])=O)-n1ccc2c(cccc12)-c1ccccc1
Show InChI InChI=1S/C25H17FN2O2/c1-15-23(25(29)30)20-14-17(26)10-11-21(20)27-24(15)28-13-12-19-18(8-5-9-22(19)28)16-6-3-2-4-7-16/h2-14H,1H3,(H,29,30)/p-1
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4.5n/an/an/an/an/an/an/an/a



DuPont Merck Pharmaceutical Company

Curated by ChEMBL


Assay Description
Immunosuppressive effect in an isolated enzyme assay using partially purified Dihydroorotate dehydrogenase from human liver for inhibition of the for...


Bioorg Med Chem Lett 8: 1745-50 (1999)


BindingDB Entry DOI: 10.7270/Q2Z89BJS
More data for this
Ligand-Target Pair
Dihydroorotate dehydrogenase (quinone), mitochondrial


(Homo sapiens (Human))
BDBM50069959
PNG
(Brequinar sodium | CHEMBL300058 | Sodium; 6-fluoro...)
Show SMILES Cc1c(nc2ccc(F)cc2c1C([O-])=O)-c1ccc(cc1)-c1ccccc1F
Show InChI InChI=1S/C23H15F2NO2/c1-13-21(23(27)28)18-12-16(24)10-11-20(18)26-22(13)15-8-6-14(7-9-15)17-4-2-3-5-19(17)25/h2-12H,1H3,(H,27,28)/p-1
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12n/an/an/an/an/an/an/an/a



DuPont Merck Pharmaceutical Company

Curated by ChEMBL


Assay Description
Immunosuppressive effect in an isolated enzyme assay using partially purified Dihydroorotate dehydrogenase from human liver for inhibition of the for...


Bioorg Med Chem Lett 8: 1745-50 (1999)


BindingDB Entry DOI: 10.7270/Q2Z89BJS
More data for this
Ligand-Target Pair
Dihydroorotate dehydrogenase (quinone), mitochondrial


(Homo sapiens (Human))
BDBM50070838
PNG
(CHEMBL51082 | Sodium; 6-fluoro-3-methyl-2-(4-pheny...)
Show SMILES Cc1c(nc2ccc(F)cc2c1C([O-])=O)N1CCc2c1cccc2-c1ccccc1
Show InChI InChI=1S/C25H19FN2O2/c1-15-23(25(29)30)20-14-17(26)10-11-21(20)27-24(15)28-13-12-19-18(8-5-9-22(19)28)16-6-3-2-4-7-16/h2-11,14H,12-13H2,1H3,(H,29,30)/p-1
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15n/an/an/an/an/an/an/an/a



DuPont Merck Pharmaceutical Company

Curated by ChEMBL


Assay Description
Immunosuppressive effect in an isolated enzyme assay using partially purified Dihydroorotate dehydrogenase from human liver for inhibition of the for...


Bioorg Med Chem Lett 8: 1745-50 (1999)


BindingDB Entry DOI: 10.7270/Q2Z89BJS
More data for this
Ligand-Target Pair
Dihydroorotate dehydrogenase (quinone), mitochondrial


(Homo sapiens (Human))
BDBM50070832
PNG
(CHEMBL49129 | Sodium; 2-(biphenyl-3-yloxy)-6-fluor...)
Show SMILES Cc1c(Oc2cccc(c2)-c2ccccc2)nc2ccc(F)cc2c1C([O-])=O
Show InChI InChI=1S/C23H16FNO3/c1-14-21(23(26)27)19-13-17(24)10-11-20(19)25-22(14)28-18-9-5-8-16(12-18)15-6-3-2-4-7-15/h2-13H,1H3,(H,26,27)/p-1
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21n/an/an/an/an/an/an/an/a



DuPont Merck Pharmaceutical Company

Curated by ChEMBL


Assay Description
Immunosuppressive effect in an isolated enzyme assay using partially purified Dihydroorotate dehydrogenase from human liver for inhibition of the for...


Bioorg Med Chem Lett 8: 1745-50 (1999)


BindingDB Entry DOI: 10.7270/Q2Z89BJS
More data for this
Ligand-Target Pair
Dihydroorotate dehydrogenase (quinone), mitochondrial


(Homo sapiens (Human))
BDBM50070851
PNG
(CHEMBL48531 | Sodium; 6-fluoro-2-(6-methoxy-4-phen...)
Show SMILES COc1cc2N(CCc2c(c1)-c1ccccc1)c1nc2ccc(F)cc2c(C([O-])=O)c1C
Show InChI InChI=1S/C26H21FN2O3/c1-15-24(26(30)31)21-12-17(27)8-9-22(21)28-25(15)29-11-10-19-20(16-6-4-3-5-7-16)13-18(32-2)14-23(19)29/h3-9,12-14H,10-11H2,1-2H3,(H,30,31)/p-1
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22n/an/an/an/an/an/an/an/a



DuPont Merck Pharmaceutical Company

Curated by ChEMBL


Assay Description
Immunosuppressive effect in an isolated enzyme assay using partially purified Dihydroorotate dehydrogenase from human liver for inhibition of the for...


Bioorg Med Chem Lett 8: 1745-50 (1999)


BindingDB Entry DOI: 10.7270/Q2Z89BJS
More data for this
Ligand-Target Pair
Dihydroorotate dehydrogenase (quinone), mitochondrial


(Homo sapiens (Human))
BDBM50070844
PNG
(CHEMBL49089 | Sodium; 6-fluoro-3-methyl-2-[1-methy...)
Show SMILES Cc1c(nc2ccc(F)cc2c1C([O-])=O)-c1cn(C)c2c(cccc12)-c1cccc(c1)C(F)(F)F
Show InChI InChI=1S/C27H18F4N2O2/c1-14-23(26(34)35)20-12-17(28)9-10-22(20)32-24(14)21-13-33(2)25-18(7-4-8-19(21)25)15-5-3-6-16(11-15)27(29,30)31/h3-13H,1-2H3,(H,34,35)/p-1
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23n/an/an/an/an/an/an/an/a



DuPont Merck Pharmaceutical Company

Curated by ChEMBL


Assay Description
Immunosuppressive effect in an isolated enzyme assay using partially purified Dihydroorotate dehydrogenase from human liver for inhibition of the for...


Bioorg Med Chem Lett 8: 1745-50 (1999)


BindingDB Entry DOI: 10.7270/Q2Z89BJS
More data for this
Ligand-Target Pair
Dihydroorotate dehydrogenase (quinone), mitochondrial


(Homo sapiens (Human))
BDBM50070841
PNG
(CHEMBL49697 | Sodium; 6-fluoro-2-[4-(2-fluoro-phen...)
Show SMILES Cc1c(nc2ccc(F)cc2c1C([O-])=O)N1CCc2c1cccc2-c1ccccc1F
Show InChI InChI=1S/C25H18F2N2O2/c1-14-23(25(30)31)19-13-15(26)9-10-21(19)28-24(14)29-12-11-18-16(6-4-8-22(18)29)17-5-2-3-7-20(17)27/h2-10,13H,11-12H2,1H3,(H,30,31)/p-1
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24n/an/an/an/an/an/an/an/a



DuPont Merck Pharmaceutical Company

Curated by ChEMBL


Assay Description
Immunosuppressive effect in an isolated enzyme assay using partially purified Dihydroorotate dehydrogenase from human liver for inhibition of the for...


Bioorg Med Chem Lett 8: 1745-50 (1999)


BindingDB Entry DOI: 10.7270/Q2Z89BJS
More data for this
Ligand-Target Pair
Dihydroorotate dehydrogenase (quinone), mitochondrial


(Homo sapiens (Human))
BDBM50070837
PNG
(CHEMBL49913 | Sodium; 6-fluoro-3-methyl-2-[4-(3-tr...)
Show SMILES Cc1c(nc2ccc(F)cc2c1C([O-])=O)N1CCc2c1cccc2-c1cccc(c1)C(F)(F)F
Show InChI InChI=1S/C26H18F4N2O2/c1-14-23(25(33)34)20-13-17(27)8-9-21(20)31-24(14)32-11-10-19-18(6-3-7-22(19)32)15-4-2-5-16(12-15)26(28,29)30/h2-9,12-13H,10-11H2,1H3,(H,33,34)/p-1
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24n/an/an/an/an/an/an/an/a



DuPont Merck Pharmaceutical Company

Curated by ChEMBL


Assay Description
Immunosuppressive effect in an isolated enzyme assay using partially purified Dihydroorotate dehydrogenase from human liver for inhibition of the for...


Bioorg Med Chem Lett 8: 1745-50 (1999)


BindingDB Entry DOI: 10.7270/Q2Z89BJS
More data for this
Ligand-Target Pair
Dihydroorotate dehydrogenase (quinone), mitochondrial


(Homo sapiens (Human))
BDBM50070846
PNG
(CHEMBL48244 | Sodium; 6-fluoro-3-methyl-2-(4-o-tol...)
Show SMILES Cc1ccccc1-c1cccc2N(CCc12)c1nc2ccc(F)cc2c(C([O-])=O)c1C
Show InChI InChI=1S/C26H21FN2O2/c1-15-6-3-4-7-18(15)19-8-5-9-23-20(19)12-13-29(23)25-16(2)24(26(30)31)21-14-17(27)10-11-22(21)28-25/h3-11,14H,12-13H2,1-2H3,(H,30,31)/p-1
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25n/an/an/an/an/an/an/an/a



DuPont Merck Pharmaceutical Company

Curated by ChEMBL


Assay Description
Immunosuppressive effect in an isolated enzyme assay using partially purified Dihydroorotate dehydrogenase from human liver for inhibition of the for...


Bioorg Med Chem Lett 8: 1745-50 (1999)


BindingDB Entry DOI: 10.7270/Q2Z89BJS
More data for this
Ligand-Target Pair
Dihydroorotate dehydrogenase (quinone), mitochondrial


(Homo sapiens (Human))
BDBM50070839
PNG
(CHEMBL48928 | Sodium; 6-fluoro-3-methyl-2-(5-pheny...)
Show SMILES Cc1c(nc2ccc(F)cc2c1C([O-])=O)-c1cccc2c(cccc12)-c1ccccc1
Show InChI InChI=1S/C27H18FNO2/c1-16-25(27(30)31)23-15-18(28)13-14-24(23)29-26(16)22-12-6-10-20-19(9-5-11-21(20)22)17-7-3-2-4-8-17/h2-15H,1H3,(H,30,31)/p-1
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26n/an/an/an/an/an/an/an/a



DuPont Merck Pharmaceutical Company

Curated by ChEMBL


Assay Description
Immunosuppressive effect in an isolated enzyme assay using partially purified Dihydroorotate dehydrogenase from human liver for inhibition of the for...


Bioorg Med Chem Lett 8: 1745-50 (1999)


BindingDB Entry DOI: 10.7270/Q2Z89BJS
More data for this
Ligand-Target Pair
Dihydroorotate dehydrogenase (quinone), mitochondrial


(Homo sapiens (Human))
BDBM50070833
PNG
(CHEMBL417722 | Sodium; 6-fluoro-3-methyl-2-(1-meth...)
Show SMILES Cc1c(nc2ccc(F)cc2c1C([O-])=O)-c1cn(C)c2c(cccc12)-c1ccccc1
Show InChI InChI=1S/C26H19FN2O2/c1-15-23(26(30)31)20-13-17(27)11-12-22(20)28-24(15)21-14-29(2)25-18(9-6-10-19(21)25)16-7-4-3-5-8-16/h3-14H,1-2H3,(H,30,31)/p-1
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27n/an/an/an/an/an/an/an/a



DuPont Merck Pharmaceutical Company

Curated by ChEMBL


Assay Description
Immunosuppressive effect in an isolated enzyme assay using partially purified Dihydroorotate dehydrogenase from human liver for inhibition of the for...


Bioorg Med Chem Lett 8: 1745-50 (1999)


BindingDB Entry DOI: 10.7270/Q2Z89BJS
More data for this
Ligand-Target Pair
Dihydroorotate dehydrogenase (quinone), mitochondrial


(Homo sapiens (Human))
BDBM50070848
PNG
(CHEMBL49214 | Sodium; 6-fluoro-2-[4-(2-methoxy-phe...)
Show SMILES COc1ccccc1-c1cccc2N(CCc12)c1nc2ccc(F)cc2c(C([O-])=O)c1C
Show InChI InChI=1S/C26H21FN2O3/c1-15-24(26(30)31)20-14-16(27)10-11-21(20)28-25(15)29-13-12-18-17(7-5-8-22(18)29)19-6-3-4-9-23(19)32-2/h3-11,14H,12-13H2,1-2H3,(H,30,31)/p-1
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30n/an/an/an/an/an/an/an/a



DuPont Merck Pharmaceutical Company

Curated by ChEMBL


Assay Description
Immunosuppressive effect in an isolated enzyme assay using partially purified Dihydroorotate dehydrogenase from human liver for inhibition of the for...


Bioorg Med Chem Lett 8: 1745-50 (1999)


BindingDB Entry DOI: 10.7270/Q2Z89BJS
More data for this
Ligand-Target Pair
Dihydroorotate dehydrogenase (quinone), mitochondrial


(Homo sapiens (Human))
BDBM50070856
PNG
(CHEMBL51243 | Sodium; 6-fluoro-2-(6-fluoro-4-pheny...)
Show SMILES Cc1c(nc2ccc(F)cc2c1C([O-])=O)N1CCc2c1cc(F)cc2-c1ccccc1
Show InChI InChI=1S/C25H18F2N2O2/c1-14-23(25(30)31)20-11-16(26)7-8-21(20)28-24(14)29-10-9-18-19(12-17(27)13-22(18)29)15-5-3-2-4-6-15/h2-8,11-13H,9-10H2,1H3,(H,30,31)/p-1
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30n/an/an/an/an/an/an/an/a



DuPont Merck Pharmaceutical Company

Curated by ChEMBL


Assay Description
Immunosuppressive effect in an isolated enzyme assay using partially purified Dihydroorotate dehydrogenase from human liver for inhibition of the for...


Bioorg Med Chem Lett 8: 1745-50 (1999)


BindingDB Entry DOI: 10.7270/Q2Z89BJS
More data for this
Ligand-Target Pair
Dihydroorotate dehydrogenase (quinone), mitochondrial


(Homo sapiens (Human))
BDBM50070842
PNG
(CHEMBL297497 | Sodium; 6-fluoro-2-[7-(3-methoxy-ph...)
Show SMILES COc1cccc(c1)-c1cccc2c(cn(C)c12)-c1nc2ccc(F)cc2c(C([O-])=O)c1C
Show InChI InChI=1S/C27H21FN2O3/c1-15-24(27(31)32)21-13-17(28)10-11-23(21)29-25(15)22-14-30(2)26-19(8-5-9-20(22)26)16-6-4-7-18(12-16)33-3/h4-14H,1-3H3,(H,31,32)/p-1
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32n/an/an/an/an/an/an/an/a



DuPont Merck Pharmaceutical Company

Curated by ChEMBL


Assay Description
Immunosuppressive effect in an isolated enzyme assay using partially purified Dihydroorotate dehydrogenase from human liver for inhibition of the for...


Bioorg Med Chem Lett 8: 1745-50 (1999)


BindingDB Entry DOI: 10.7270/Q2Z89BJS
More data for this
Ligand-Target Pair
Dihydroorotate dehydrogenase (quinone), mitochondrial


(Homo sapiens (Human))
BDBM50070854
PNG
(CHEMBL50279 | Sodium; 6-fluoro-2-[4-(3-methoxy-phe...)
Show SMILES COc1cccc(c1)-c1cccc2N(CCc12)c1nc2ccc(F)cc2c(C([O-])=O)c1C
Show InChI InChI=1S/C26H21FN2O3/c1-15-24(26(30)31)21-14-17(27)9-10-22(21)28-25(15)29-12-11-20-19(7-4-8-23(20)29)16-5-3-6-18(13-16)32-2/h3-10,13-14H,11-12H2,1-2H3,(H,30,31)/p-1
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34n/an/an/an/an/an/an/an/a



DuPont Merck Pharmaceutical Company

Curated by ChEMBL


Assay Description
Immunosuppressive effect in an isolated enzyme assay using partially purified Dihydroorotate dehydrogenase from human liver for inhibition of the for...


Bioorg Med Chem Lett 8: 1745-50 (1999)


BindingDB Entry DOI: 10.7270/Q2Z89BJS
More data for this
Ligand-Target Pair
Dihydroorotate dehydrogenase (quinone), mitochondrial


(Homo sapiens (Human))
BDBM50070835
PNG
(CHEMBL49840 | Sodium; 6-fluoro-2-[7-(2-methoxy-phe...)
Show SMILES COc1ccccc1-c1cccc2c(cn(C)c12)-c1nc2ccc(F)cc2c(C([O-])=O)c1C
Show InChI InChI=1S/C27H21FN2O3/c1-15-24(27(31)32)20-13-16(28)11-12-22(20)29-25(15)21-14-30(2)26-18(8-6-9-19(21)26)17-7-4-5-10-23(17)33-3/h4-14H,1-3H3,(H,31,32)/p-1
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40n/an/an/an/an/an/an/an/a



DuPont Merck Pharmaceutical Company

Curated by ChEMBL


Assay Description
Immunosuppressive effect in an isolated enzyme assay using partially purified Dihydroorotate dehydrogenase from human liver for inhibition of the for...


Bioorg Med Chem Lett 8: 1745-50 (1999)


BindingDB Entry DOI: 10.7270/Q2Z89BJS
More data for this
Ligand-Target Pair
Dihydroorotate dehydrogenase (quinone), mitochondrial


(Homo sapiens (Human))
BDBM50070855
PNG
(CHEMBL49331 | Sodium; 6-fluoro-3-methyl-2-(4-pheny...)
Show SMILES Cc1c(nc2ccc(F)cc2c1C([O-])=O)-n1cnc2c(cccc12)-c1ccccc1
Show InChI InChI=1S/C24H16FN3O2/c1-14-21(24(29)30)18-12-16(25)10-11-19(18)27-23(14)28-13-26-22-17(8-5-9-20(22)28)15-6-3-2-4-7-15/h2-13H,1H3,(H,29,30)/p-1
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71n/an/an/an/an/an/an/an/a



DuPont Merck Pharmaceutical Company

Curated by ChEMBL


Assay Description
Immunosuppressive effect in an isolated enzyme assay using partially purified Dihydroorotate dehydrogenase from human liver for inhibition of the for...


Bioorg Med Chem Lett 8: 1745-50 (1999)


BindingDB Entry DOI: 10.7270/Q2Z89BJS
More data for this
Ligand-Target Pair
Dihydroorotate dehydrogenase (quinone), mitochondrial


(Homo sapiens (Human))
BDBM50070836
PNG
(CHEMBL50441 | Sodium; 2-(biphenyl-3-ylamino)-6-flu...)
Show SMILES Cc1c(Nc2cccc(c2)-c2ccccc2)nc2ccc(F)cc2c1C([O-])=O
Show InChI InChI=1S/C23H17FN2O2/c1-14-21(23(27)28)19-13-17(24)10-11-20(19)26-22(14)25-18-9-5-8-16(12-18)15-6-3-2-4-7-15/h2-13H,1H3,(H,25,26)(H,27,28)/p-1
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83n/an/an/an/an/an/an/an/a



DuPont Merck Pharmaceutical Company

Curated by ChEMBL


Assay Description
Immunosuppressive effect in an isolated enzyme assay using partially purified Dihydroorotate dehydrogenase from human liver for inhibition of the for...


Bioorg Med Chem Lett 8: 1745-50 (1999)


BindingDB Entry DOI: 10.7270/Q2Z89BJS
More data for this
Ligand-Target Pair
Dihydroorotate dehydrogenase (quinone), mitochondrial


(Homo sapiens (Human))
BDBM50070840
PNG
(CHEMBL50494 | Sodium; 6-fluoro-3-methyl-2-(7-pheny...)
Show SMILES Cc1c(nc2ccc(F)cc2c1C([O-])=O)-c1c[nH]c2c(cccc12)-c1ccccc1
Show InChI InChI=1S/C25H17FN2O2/c1-14-22(25(29)30)19-12-16(26)10-11-21(19)28-23(14)20-13-27-24-17(8-5-9-18(20)24)15-6-3-2-4-7-15/h2-13,27H,1H3,(H,29,30)/p-1
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>130n/an/an/an/an/an/an/an/a



DuPont Merck Pharmaceutical Company

Curated by ChEMBL


Assay Description
Immunosuppressive effect in an isolated enzyme assay using partially purified Dihydroorotate dehydrogenase from human liver for inhibition of the for...


Bioorg Med Chem Lett 8: 1745-50 (1999)


BindingDB Entry DOI: 10.7270/Q2Z89BJS
More data for this
Ligand-Target Pair
Dihydroorotate dehydrogenase (quinone), mitochondrial


(Homo sapiens (Human))
BDBM50070834
PNG
(CHEMBL49328 | Sodium; 6-fluoro-3-methyl-2-phenylam...)
Show SMILES Cc1c(Nc2ccccc2)nc2ccc(F)cc2c1C([O-])=O
Show InChI InChI=1S/C17H13FN2O2/c1-10-15(17(21)22)13-9-11(18)7-8-14(13)20-16(10)19-12-5-3-2-4-6-12/h2-9H,1H3,(H,19,20)(H,21,22)/p-1
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>200n/an/an/an/an/an/an/an/a



DuPont Merck Pharmaceutical Company

Curated by ChEMBL


Assay Description
Immunosuppressive effect in an isolated enzyme assay using partially purified Dihydroorotate dehydrogenase from human liver for inhibition of the for...


Bioorg Med Chem Lett 8: 1745-50 (1999)


BindingDB Entry DOI: 10.7270/Q2Z89BJS
More data for this
Ligand-Target Pair
Dihydroorotate dehydrogenase (quinone), mitochondrial


(Homo sapiens (Human))
BDBM50070843
PNG
(CHEMBL45691 | Sodium; 2-(biphenyl-4-ylmethoxy)-6-f...)
Show SMILES Cc1c(OCc2ccc(cc2)-c2ccccc2)nc2ccc(F)cc2c1C([O-])=O
Show InChI InChI=1S/C24H18FNO3/c1-15-22(24(27)28)20-13-19(25)11-12-21(20)26-23(15)29-14-16-7-9-18(10-8-16)17-5-3-2-4-6-17/h2-13H,14H2,1H3,(H,27,28)/p-1
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>200n/an/an/an/an/an/an/an/a



DuPont Merck Pharmaceutical Company

Curated by ChEMBL


Assay Description
Immunosuppressive effect in an isolated enzyme assay using partially purified Dihydroorotate dehydrogenase from human liver for inhibition of the for...


Bioorg Med Chem Lett 8: 1745-50 (1999)


BindingDB Entry DOI: 10.7270/Q2Z89BJS
More data for this
Ligand-Target Pair
Dihydroorotate dehydrogenase (quinone), mitochondrial


(Homo sapiens (Human))
BDBM50070850
PNG
(CHEMBL430760 | Sodium; 2-(biphenyl-3-yl-methyl-ami...)
Show SMILES CN(c1cccc(c1)-c1ccccc1)c1nc2ccc(F)cc2c(C([O-])=O)c1C
Show InChI InChI=1S/C24H19FN2O2/c1-15-22(24(28)29)20-14-18(25)11-12-21(20)26-23(15)27(2)19-10-6-9-17(13-19)16-7-4-3-5-8-16/h3-14H,1-2H3,(H,28,29)/p-1
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240n/an/an/an/an/an/an/an/a



DuPont Merck Pharmaceutical Company

Curated by ChEMBL


Assay Description
Immunosuppressive effect in an isolated enzyme assay using partially purified Dihydroorotate dehydrogenase from human liver for inhibition of the for...


Bioorg Med Chem Lett 8: 1745-50 (1999)


BindingDB Entry DOI: 10.7270/Q2Z89BJS
More data for this
Ligand-Target Pair
Dihydroorotate dehydrogenase (quinone), mitochondrial


(Homo sapiens (Human))
BDBM50070847
PNG
(CHEMBL51927 | Sodium; 2-(biphenyl-3-ylmethoxy)-6-f...)
Show SMILES Cc1c(OCc2cccc(c2)-c2ccccc2)nc2ccc(F)cc2c1C([O-])=O
Show InChI InChI=1S/C24H18FNO3/c1-15-22(24(27)28)20-13-19(25)10-11-21(20)26-23(15)29-14-16-6-5-9-18(12-16)17-7-3-2-4-8-17/h2-13H,14H2,1H3,(H,27,28)/p-1
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330n/an/an/an/an/an/an/an/a



DuPont Merck Pharmaceutical Company

Curated by ChEMBL


Assay Description
Immunosuppressive effect in an isolated enzyme assay using partially purified Dihydroorotate dehydrogenase from human liver for inhibition of the for...


Bioorg Med Chem Lett 8: 1745-50 (1999)


BindingDB Entry DOI: 10.7270/Q2Z89BJS
More data for this
Ligand-Target Pair
Dihydroorotate dehydrogenase (quinone), mitochondrial


(Homo sapiens (Human))
BDBM50070853
PNG
(CHEMBL298568 | Sodium; 2-(acetyl-biphenyl-3-yl-ami...)
Show SMILES CC(=O)N(c1cccc(c1)-c1ccccc1)c1nc2ccc(F)cc2c(C([O-])=O)c1C
Show InChI InChI=1S/C25H19FN2O3/c1-15-23(25(30)31)21-14-19(26)11-12-22(21)27-24(15)28(16(2)29)20-10-6-9-18(13-20)17-7-4-3-5-8-17/h3-14H,1-2H3,(H,30,31)/p-1
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>390n/an/an/an/an/an/an/an/a



DuPont Merck Pharmaceutical Company

Curated by ChEMBL


Assay Description
Immunosuppressive effect in an isolated enzyme assay using partially purified Dihydroorotate dehydrogenase from human liver for inhibition of the for...


Bioorg Med Chem Lett 8: 1745-50 (1999)


BindingDB Entry DOI: 10.7270/Q2Z89BJS
More data for this
Ligand-Target Pair
Dihydroorotate dehydrogenase (quinone), mitochondrial


(Homo sapiens (Human))
BDBM50070849
PNG
(CHEMBL49569 | Sodium; 2-(biphenyl-4-ylamino)-6-flu...)
Show SMILES Cc1c(Nc2ccc(cc2)-c2ccccc2)nc2ccc(F)cc2c1C([O-])=O
Show InChI InChI=1S/C23H17FN2O2/c1-14-21(23(27)28)19-13-17(24)9-12-20(19)26-22(14)25-18-10-7-16(8-11-18)15-5-3-2-4-6-15/h2-13H,1H3,(H,25,26)(H,27,28)/p-1
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>430n/an/an/an/an/an/an/an/a



DuPont Merck Pharmaceutical Company

Curated by ChEMBL


Assay Description
Immunosuppressive effect in an isolated enzyme assay using partially purified Dihydroorotate dehydrogenase from human liver for inhibition of the for...


Bioorg Med Chem Lett 8: 1745-50 (1999)


BindingDB Entry DOI: 10.7270/Q2Z89BJS
More data for this
Ligand-Target Pair
Dihydroorotate dehydrogenase (quinone), mitochondrial


(Homo sapiens (Human))
BDBM50070845
PNG
(CHEMBL48753 | Sodium; 6-fluoro-3-methyl-2-phenoxy-...)
Show SMILES Cc1c(Oc2ccccc2)nc2ccc(F)cc2c1C([O-])=O
Show InChI InChI=1S/C17H12FNO3/c1-10-15(17(20)21)13-9-11(18)7-8-14(13)19-16(10)22-12-5-3-2-4-6-12/h2-9H,1H3,(H,20,21)/p-1
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>1.00E+3n/an/an/an/an/an/an/an/a



DuPont Merck Pharmaceutical Company

Curated by ChEMBL


Assay Description
Immunosuppressive effect in an isolated enzyme assay using partially purified Dihydroorotate dehydrogenase from human liver for inhibition of the for...


Bioorg Med Chem Lett 8: 1745-50 (1999)


BindingDB Entry DOI: 10.7270/Q2Z89BJS
More data for this
Ligand-Target Pair
Dihydroorotate dehydrogenase (quinone), mitochondrial


(Homo sapiens (Human))
BDBM50070852
PNG
(CHEMBL49516 | Sodium; 2-(biphenyl-4-yloxy)-6-fluor...)
Show SMILES Cc1c(Oc2ccc(cc2)-c2ccccc2)nc2ccc(F)cc2c1C([O-])=O
Show InChI InChI=1S/C23H16FNO3/c1-14-21(23(26)27)19-13-17(24)9-12-20(19)25-22(14)28-18-10-7-16(8-11-18)15-5-3-2-4-6-15/h2-13H,1H3,(H,26,27)/p-1
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>1.00E+3n/an/an/an/an/an/an/an/a



DuPont Merck Pharmaceutical Company

Curated by ChEMBL


Assay Description
Immunosuppressive effect in an isolated enzyme assay using partially purified Dihydroorotate dehydrogenase from human liver for inhibition of the for...


Bioorg Med Chem Lett 8: 1745-50 (1999)


BindingDB Entry DOI: 10.7270/Q2Z89BJS
More data for this
Ligand-Target Pair