Found 150 hits with Last Name = 'tabuchi' and Initial = 't' Target/Host
(Institution) | Ligand | Target/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 | pH | Temp
°C |
|---|
Dihydroorotate dehydrogenase (quinone), mitochondrial
(Homo sapiens (Human)) | BDBM50211727
(CHEMBL3974614)Show SMILES NCCO.OC(=O)c1[nH]c(=O)[nH]c(=O)c1CCc1ccc(cc1)-c1ccccc1 Show InChI InChI=1S/C19H16N2O4/c22-17-15(16(18(23)24)20-19(25)21-17)11-8-12-6-9-14(10-7-12)13-4-2-1-3-5-13/h1-7,9-10H,8,11H2,(H,23,24)(H2,20,21,22,25) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 485 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Nagasaki University
Curated by ChEMBL
| Assay Description
Inhibition of human dihydroorotate dehydrogenase assessed as reduction in orotate production using L-dihydroorotate as substrate measured after 20 mi... |
Bioorg Med Chem 25: 1465-1470 (2017)
Article DOI: 10.1016/j.bmc.2017.01.009
BindingDB Entry DOI: 10.7270/Q2CC12TS |
More data for this
Ligand-Target Pair | |
Dihydroorotate dehydrogenase (quinone), mitochondrial
(Homo sapiens (Human)) | BDBM50211940
(CHEMBL3966747)Show SMILES NCCO.OC(=O)c1[nH]c(=O)[nH]c(=O)c1CCc1cc2ccccc2c2ccccc12 Show InChI InChI=1S/C21H16N2O4/c24-19-17(18(20(25)26)22-21(27)23-19)10-9-13-11-12-5-1-2-6-14(12)16-8-4-3-7-15(13)16/h1-8,11H,9-10H2,(H,25,26)(H2,22,23,24,27) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| 2.07E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Nagasaki University
Curated by ChEMBL
| Assay Description
Inhibition of human dihydroorotate dehydrogenase assessed as reduction in orotate production using L-dihydroorotate as substrate measured after 20 mi... |
Bioorg Med Chem 25: 1465-1470 (2017)
Article DOI: 10.1016/j.bmc.2017.01.009
BindingDB Entry DOI: 10.7270/Q2CC12TS |
More data for this
Ligand-Target Pair | |
Dihydroorotate dehydrogenase (quinone), mitochondrial
(Homo sapiens (Human)) | BDBM50211954
(CHEMBL3901542)Show SMILES NCCO.Cc1ccc(CCc2c([nH]c(=O)[nH]c2=O)C(O)=O)cc1 Show InChI InChI=1S/C14H14N2O4/c1-8-2-4-9(5-3-8)6-7-10-11(13(18)19)15-14(20)16-12(10)17/h2-5H,6-7H2,1H3,(H,18,19)(H2,15,16,17,20) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 2.88E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Nagasaki University
Curated by ChEMBL
| Assay Description
Inhibition of human dihydroorotate dehydrogenase assessed as reduction in orotate production using L-dihydroorotate as substrate measured after 20 mi... |
Bioorg Med Chem 25: 1465-1470 (2017)
Article DOI: 10.1016/j.bmc.2017.01.009
BindingDB Entry DOI: 10.7270/Q2CC12TS |
More data for this
Ligand-Target Pair | |
Dihydroorotate dehydrogenase (quinone), mitochondrial
(Homo sapiens (Human)) | BDBM50211709
(CHEMBL3926030)Show SMILES NCCO.OC(=O)c1[nH]c(=O)[nH]c(=O)c1CCc1cc(cc(c1)C(F)(F)F)C(F)(F)F Show InChI InChI=1S/C15H10F6N2O4/c16-14(17,18)7-3-6(4-8(5-7)15(19,20)21)1-2-9-10(12(25)26)22-13(27)23-11(9)24/h3-5H,1-2H2,(H,25,26)(H2,22,23,24,27) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| 5.70E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Nagasaki University
Curated by ChEMBL
| Assay Description
Inhibition of human dihydroorotate dehydrogenase assessed as reduction in orotate production using L-dihydroorotate as substrate measured after 20 mi... |
Bioorg Med Chem 25: 1465-1470 (2017)
Article DOI: 10.1016/j.bmc.2017.01.009
BindingDB Entry DOI: 10.7270/Q2CC12TS |
More data for this
Ligand-Target Pair | |
Dihydroorotate dehydrogenase (quinone), mitochondrial
(Homo sapiens (Human)) | BDBM50211702
(CHEMBL3962745)Show SMILES NCCO.COc1ccc2ccc(CCc3c([nH]c(=O)[nH]c3=O)C(O)=O)cc2c1 Show InChI InChI=1S/C18H16N2O5/c1-25-13-6-5-11-4-2-10(8-12(11)9-13)3-7-14-15(17(22)23)19-18(24)20-16(14)21/h2,4-6,8-9H,3,7H2,1H3,(H,22,23)(H2,19,20,21,24) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
| Article
PubMed
| 6.65E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Nagasaki University
Curated by ChEMBL
| Assay Description
Inhibition of human dihydroorotate dehydrogenase assessed as reduction in orotate production using L-dihydroorotate as substrate measured after 20 mi... |
Bioorg Med Chem 25: 1465-1470 (2017)
Article DOI: 10.1016/j.bmc.2017.01.009
BindingDB Entry DOI: 10.7270/Q2CC12TS |
More data for this
Ligand-Target Pair | |
Dihydroorotate dehydrogenase (quinone), mitochondrial
(Homo sapiens (Human)) | BDBM50211957
(CHEMBL3943890)Show SMILES NCCO.OC(=O)c1[nH]c(=O)[nH]c(=O)c1CCc1ccc(Oc2ccccc2)cc1 Show InChI InChI=1S/C19H16N2O5/c22-17-15(16(18(23)24)20-19(25)21-17)11-8-12-6-9-14(10-7-12)26-13-4-2-1-3-5-13/h1-7,9-10H,8,11H2,(H,23,24)(H2,20,21,22,25) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| 8.30E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Nagasaki University
Curated by ChEMBL
| Assay Description
Inhibition of human dihydroorotate dehydrogenase assessed as reduction in orotate production using L-dihydroorotate as substrate measured after 20 mi... |
Bioorg Med Chem 25: 1465-1470 (2017)
Article DOI: 10.1016/j.bmc.2017.01.009
BindingDB Entry DOI: 10.7270/Q2CC12TS |
More data for this
Ligand-Target Pair | |
Dihydroorotate dehydrogenase (quinone), mitochondrial
(Homo sapiens (Human)) | BDBM50211731
(CHEMBL3892598)Show SMILES NCCO.CC(C)(C)c1ccc(CCc2c([nH]c(=O)[nH]c2=O)C(O)=O)cc1 Show InChI InChI=1S/C17H20N2O4/c1-17(2,3)11-7-4-10(5-8-11)6-9-12-13(15(21)22)18-16(23)19-14(12)20/h4-5,7-8H,6,9H2,1-3H3,(H,21,22)(H2,18,19,20,23) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
| Article
PubMed
| 8.40E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Nagasaki University
Curated by ChEMBL
| Assay Description
Inhibition of human dihydroorotate dehydrogenase assessed as reduction in orotate production using L-dihydroorotate as substrate measured after 20 mi... |
Bioorg Med Chem 25: 1465-1470 (2017)
Article DOI: 10.1016/j.bmc.2017.01.009
BindingDB Entry DOI: 10.7270/Q2CC12TS |
More data for this
Ligand-Target Pair | |
Dihydroorotate dehydrogenase (quinone), mitochondrial
(Homo sapiens (Human)) | BDBM50211716
(CHEMBL3973700)Show SMILES NCCO.COc1ccc2c(CCc3c([nH]c(=O)[nH]c3=O)C(O)=O)cccc2c1 Show InChI InChI=1S/C18H16N2O5/c1-25-12-6-8-13-10(3-2-4-11(13)9-12)5-7-14-15(17(22)23)19-18(24)20-16(14)21/h2-4,6,8-9H,5,7H2,1H3,(H,22,23)(H2,19,20,21,24) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| 1.02E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Nagasaki University
Curated by ChEMBL
| Assay Description
Inhibition of human dihydroorotate dehydrogenase assessed as reduction in orotate production using L-dihydroorotate as substrate measured after 20 mi... |
Bioorg Med Chem 25: 1465-1470 (2017)
Article DOI: 10.1016/j.bmc.2017.01.009
BindingDB Entry DOI: 10.7270/Q2CC12TS |
More data for this
Ligand-Target Pair | |
Dihydroorotate dehydrogenase (quinone), mitochondrial
(Homo sapiens (Human)) | BDBM50211943
(CHEMBL3914213)Show SMILES NCCO.COc1cccc2cc(CCc3c([nH]c(=O)[nH]c3=O)C(O)=O)ccc12 Show InChI InChI=1S/C18H16N2O5/c1-25-14-4-2-3-11-9-10(5-7-12(11)14)6-8-13-15(17(22)23)19-18(24)20-16(13)21/h2-5,7,9H,6,8H2,1H3,(H,22,23)(H2,19,20,21,24) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| 1.03E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Nagasaki University
Curated by ChEMBL
| Assay Description
Inhibition of human dihydroorotate dehydrogenase assessed as reduction in orotate production using L-dihydroorotate as substrate measured after 20 mi... |
Bioorg Med Chem 25: 1465-1470 (2017)
Article DOI: 10.1016/j.bmc.2017.01.009
BindingDB Entry DOI: 10.7270/Q2CC12TS |
More data for this
Ligand-Target Pair | |
Dihydroorotate dehydrogenase (quinone), mitochondrial
(Homo sapiens (Human)) | BDBM50211705
(CHEMBL3964957)Show SMILES NCCO.COc1cccc2ccc(CCc3c([nH]c(=O)[nH]c3=O)C(O)=O)cc12 Show InChI InChI=1S/C18H16N2O5/c1-25-14-4-2-3-11-7-5-10(9-13(11)14)6-8-12-15(17(22)23)19-18(24)20-16(12)21/h2-5,7,9H,6,8H2,1H3,(H,22,23)(H2,19,20,21,24) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| 1.13E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Nagasaki University
Curated by ChEMBL
| Assay Description
Inhibition of human dihydroorotate dehydrogenase assessed as reduction in orotate production using L-dihydroorotate as substrate measured after 20 mi... |
Bioorg Med Chem 25: 1465-1470 (2017)
Article DOI: 10.1016/j.bmc.2017.01.009
BindingDB Entry DOI: 10.7270/Q2CC12TS |
More data for this
Ligand-Target Pair | |
Dihydroorotate dehydrogenase (quinone), mitochondrial
(Homo sapiens (Human)) | BDBM50211959
(CHEMBL3955099)Show SMILES NCCO.COC(=O)c1cccc2cc(CCCCc3c([nH]c(=O)[nH]c3=O)C(O)=O)ccc12 Show InChI InChI=1S/C21H20N2O6/c1-29-20(27)15-8-4-6-13-11-12(9-10-14(13)15)5-2-3-7-16-17(19(25)26)22-21(28)23-18(16)24/h4,6,8-11H,2-3,5,7H2,1H3,(H,25,26)(H2,22,23,24,28) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 1.20E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Nagasaki University
Curated by ChEMBL
| Assay Description
Inhibition of human dihydroorotate dehydrogenase assessed as reduction in orotate production using L-dihydroorotate as substrate measured after 20 mi... |
Bioorg Med Chem 25: 1465-1470 (2017)
Article DOI: 10.1016/j.bmc.2017.01.009
BindingDB Entry DOI: 10.7270/Q2CC12TS |
More data for this
Ligand-Target Pair | |
Dihydroorotate dehydrogenase (quinone), mitochondrial
(Homo sapiens (Human)) | BDBM50211710
(CHEMBL3936361)Show SMILES NCCO.COCOc1ccc2ccc(CCc3c([nH]c(=O)[nH]c3=O)C(O)=O)cc2c1 Show InChI InChI=1S/C19H18N2O6/c1-26-10-27-14-6-5-12-4-2-11(8-13(12)9-14)3-7-15-16(18(23)24)20-19(25)21-17(15)22/h2,4-6,8-9H,3,7,10H2,1H3,(H,23,24)(H2,20,21,22,25) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| 1.58E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Nagasaki University
Curated by ChEMBL
| Assay Description
Inhibition of human dihydroorotate dehydrogenase assessed as reduction in orotate production using L-dihydroorotate as substrate measured after 20 mi... |
Bioorg Med Chem 25: 1465-1470 (2017)
Article DOI: 10.1016/j.bmc.2017.01.009
BindingDB Entry DOI: 10.7270/Q2CC12TS |
More data for this
Ligand-Target Pair | |
Dihydroorotate dehydrogenase (quinone), mitochondrial
(Homo sapiens (Human)) | BDBM50211942
(CHEMBL3935254)Show SMILES NCCO.COc1cc2ccccc2cc1CCc1c([nH]c(=O)[nH]c1=O)C(O)=O Show InChI InChI=1S/C18H16N2O5/c1-25-14-9-11-5-3-2-4-10(11)8-12(14)6-7-13-15(17(22)23)19-18(24)20-16(13)21/h2-5,8-9H,6-7H2,1H3,(H,22,23)(H2,19,20,21,24) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| 1.99E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Nagasaki University
Curated by ChEMBL
| Assay Description
Inhibition of human dihydroorotate dehydrogenase assessed as reduction in orotate production using L-dihydroorotate as substrate measured after 20 mi... |
Bioorg Med Chem 25: 1465-1470 (2017)
Article DOI: 10.1016/j.bmc.2017.01.009
BindingDB Entry DOI: 10.7270/Q2CC12TS |
More data for this
Ligand-Target Pair | |
Dihydroorotate dehydrogenase (quinone), mitochondrial
(Homo sapiens (Human)) | BDBM50212058
(CHEMBL3928909)Show SMILES NCCO.CN(C)C(=O)c1cccc2cc(CCc3c([nH]c(=O)[nH]c3=O)C(O)=O)ccc12 Show InChI InChI=1S/C20H19N3O5/c1-23(2)18(25)14-5-3-4-12-10-11(6-8-13(12)14)7-9-15-16(19(26)27)21-20(28)22-17(15)24/h3-6,8,10H,7,9H2,1-2H3,(H,26,27)(H2,21,22,24,28) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 2.02E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Nagasaki University
Curated by ChEMBL
| Assay Description
Inhibition of human dihydroorotate dehydrogenase assessed as reduction in orotate production using L-dihydroorotate as substrate measured after 20 mi... |
Bioorg Med Chem 25: 1465-1470 (2017)
Article DOI: 10.1016/j.bmc.2017.01.009
BindingDB Entry DOI: 10.7270/Q2CC12TS |
More data for this
Ligand-Target Pair | |
Dihydroorotate dehydrogenase (quinone), mitochondrial
(Homo sapiens (Human)) | BDBM50211695
(CHEMBL3933268)Show SMILES NCCO.COC(=O)c1cccc2cc(CCc3c([nH]c(=O)[nH]c3=O)C(O)=O)ccc12 Show InChI InChI=1S/C19H16N2O6/c1-27-18(25)13-4-2-3-11-9-10(5-7-12(11)13)6-8-14-15(17(23)24)20-19(26)21-16(14)22/h2-5,7,9H,6,8H2,1H3,(H,23,24)(H2,20,21,22,26) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 2.22E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Nagasaki University
Curated by ChEMBL
| Assay Description
Inhibition of human dihydroorotate dehydrogenase assessed as reduction in orotate production using L-dihydroorotate as substrate measured after 20 mi... |
Bioorg Med Chem 25: 1465-1470 (2017)
Article DOI: 10.1016/j.bmc.2017.01.009
BindingDB Entry DOI: 10.7270/Q2CC12TS |
More data for this
Ligand-Target Pair | |
Dihydroorotate dehydrogenase (quinone), mitochondrial
(Homo sapiens (Human)) | BDBM50211712
(CHEMBL3905364)Show SMILES NCCO.COCOc1cc2ccccc2cc1CCc1c([nH]c(=O)[nH]c1=O)C(O)=O Show InChI InChI=1S/C19H18N2O6/c1-26-10-27-15-9-12-5-3-2-4-11(12)8-13(15)6-7-14-16(18(23)24)20-19(25)21-17(14)22/h2-5,8-9H,6-7,10H2,1H3,(H,23,24)(H2,20,21,22,25) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 2.22E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Nagasaki University
Curated by ChEMBL
| Assay Description
Inhibition of human dihydroorotate dehydrogenase assessed as reduction in orotate production using L-dihydroorotate as substrate measured after 20 mi... |
Bioorg Med Chem 25: 1465-1470 (2017)
Article DOI: 10.1016/j.bmc.2017.01.009
BindingDB Entry DOI: 10.7270/Q2CC12TS |
More data for this
Ligand-Target Pair | |
Dihydroorotate dehydrogenase (quinone), mitochondrial
(Homo sapiens (Human)) | BDBM50211939
(CHEMBL3984245)Show SMILES NCCO.OC(=O)c1[nH]c(=O)[nH]c(=O)c1CCc1ccc2ccccc2c1 Show InChI InChI=1S/C17H14N2O4/c20-15-13(14(16(21)22)18-17(23)19-15)8-6-10-5-7-11-3-1-2-4-12(11)9-10/h1-5,7,9H,6,8H2,(H,21,22)(H2,18,19,20,23) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| 2.31E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Nagasaki University
Curated by ChEMBL
| Assay Description
Inhibition of human dihydroorotate dehydrogenase assessed as reduction in orotate production using L-dihydroorotate as substrate measured after 20 mi... |
Bioorg Med Chem 25: 1465-1470 (2017)
Article DOI: 10.1016/j.bmc.2017.01.009
BindingDB Entry DOI: 10.7270/Q2CC12TS |
More data for this
Ligand-Target Pair | |
Dihydroorotate dehydrogenase (quinone), mitochondrial
(Homo sapiens (Human)) | BDBM50211715
(CHEMBL3925700)Show SMILES NCCO.COc1ccc2cc(CCc3c([nH]c(=O)[nH]c3=O)C(O)=O)ccc2c1 Show InChI InChI=1S/C18H16N2O5/c1-25-13-6-5-11-8-10(2-4-12(11)9-13)3-7-14-15(17(22)23)19-18(24)20-16(14)21/h2,4-6,8-9H,3,7H2,1H3,(H,22,23)(H2,19,20,21,24) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 2.31E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Nagasaki University
Curated by ChEMBL
| Assay Description
Inhibition of human dihydroorotate dehydrogenase assessed as reduction in orotate production using L-dihydroorotate as substrate measured after 20 mi... |
Bioorg Med Chem 25: 1465-1470 (2017)
Article DOI: 10.1016/j.bmc.2017.01.009
BindingDB Entry DOI: 10.7270/Q2CC12TS |
More data for this
Ligand-Target Pair | |
Dihydroorotate dehydrogenase (quinone), mitochondrial
(Homo sapiens (Human)) | BDBM50212059
(CHEMBL3945267)Show SMILES NCCO.COc1ccc2cc(CCc3c([nH]c(=O)[nH]c3=O)C(O)=O)c(OC)cc2c1 Show InChI InChI=1S/C19H18N2O6/c1-26-13-5-3-10-7-11(15(27-2)9-12(10)8-13)4-6-14-16(18(23)24)20-19(25)21-17(14)22/h3,5,7-9H,4,6H2,1-2H3,(H,23,24)(H2,20,21,22,25) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 2.39E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Nagasaki University
Curated by ChEMBL
| Assay Description
Inhibition of human dihydroorotate dehydrogenase assessed as reduction in orotate production using L-dihydroorotate as substrate measured after 20 mi... |
Bioorg Med Chem 25: 1465-1470 (2017)
Article DOI: 10.1016/j.bmc.2017.01.009
BindingDB Entry DOI: 10.7270/Q2CC12TS |
More data for this
Ligand-Target Pair | |
Dihydroorotate dehydrogenase (quinone), mitochondrial
(Homo sapiens (Human)) | BDBM50211714
(CHEMBL3938624)Show SMILES NCCO.COC(=O)c1ccc2cc(CCCCc3c([nH]c(=O)[nH]c3=O)C(O)=O)ccc2c1 Show InChI InChI=1S/C21H20N2O6/c1-29-20(27)15-9-8-13-10-12(6-7-14(13)11-15)4-2-3-5-16-17(19(25)26)22-21(28)23-18(16)24/h6-11H,2-5H2,1H3,(H,25,26)(H2,22,23,24,28) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| 2.61E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Nagasaki University
Curated by ChEMBL
| Assay Description
Inhibition of human dihydroorotate dehydrogenase assessed as reduction in orotate production using L-dihydroorotate as substrate measured after 20 mi... |
Bioorg Med Chem 25: 1465-1470 (2017)
Article DOI: 10.1016/j.bmc.2017.01.009
BindingDB Entry DOI: 10.7270/Q2CC12TS |
More data for this
Ligand-Target Pair | |
Dihydroorotate dehydrogenase (quinone), mitochondrial
(Homo sapiens (Human)) | BDBM50211941
(CHEMBL3904389)Show SMILES NCCO.COc1ccc2cccc(CCc3c([nH]c(=O)[nH]c3=O)C(O)=O)c2c1 Show InChI InChI=1S/C18H16N2O5/c1-25-12-7-5-10-3-2-4-11(14(10)9-12)6-8-13-15(17(22)23)19-18(24)20-16(13)21/h2-5,7,9H,6,8H2,1H3,(H,22,23)(H2,19,20,21,24) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| 3.41E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Nagasaki University
Curated by ChEMBL
| Assay Description
Inhibition of human dihydroorotate dehydrogenase assessed as reduction in orotate production using L-dihydroorotate as substrate measured after 20 mi... |
Bioorg Med Chem 25: 1465-1470 (2017)
Article DOI: 10.1016/j.bmc.2017.01.009
BindingDB Entry DOI: 10.7270/Q2CC12TS |
More data for this
Ligand-Target Pair | |
Dihydroorotate dehydrogenase (quinone), mitochondrial
(Homo sapiens (Human)) | BDBM50212056
(CHEMBL3960727)Show SMILES NCCO.COC(=O)c1ccc2cc(CCc3c([nH]c(=O)[nH]c3=O)C(O)=O)ccc2c1 Show InChI InChI=1S/C19H16N2O6/c1-27-18(25)13-6-5-11-8-10(2-4-12(11)9-13)3-7-14-15(17(23)24)20-19(26)21-16(14)22/h2,4-6,8-9H,3,7H2,1H3,(H,23,24)(H2,20,21,22,26) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 3.88E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Nagasaki University
Curated by ChEMBL
| Assay Description
Inhibition of human dihydroorotate dehydrogenase assessed as reduction in orotate production using L-dihydroorotate as substrate measured after 20 mi... |
Bioorg Med Chem 25: 1465-1470 (2017)
Article DOI: 10.1016/j.bmc.2017.01.009
BindingDB Entry DOI: 10.7270/Q2CC12TS |
More data for this
Ligand-Target Pair | |
Dihydroorotate dehydrogenase (quinone), mitochondrial
(Homo sapiens (Human)) | BDBM50211787
(CHEMBL3986776)Show SMILES NCCO.OC(=O)c1[nH]c(=O)[nH]c(=O)c1CCc1ccc(OC(F)(F)F)cc1 Show InChI InChI=1S/C14H11F3N2O5/c15-14(16,17)24-8-4-1-7(2-5-8)3-6-9-10(12(21)22)18-13(23)19-11(9)20/h1-2,4-5H,3,6H2,(H,21,22)(H2,18,19,20,23) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 4.12E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Nagasaki University
Curated by ChEMBL
| Assay Description
Inhibition of human dihydroorotate dehydrogenase assessed as reduction in orotate production using L-dihydroorotate as substrate measured after 20 mi... |
Bioorg Med Chem 25: 1465-1470 (2017)
Article DOI: 10.1016/j.bmc.2017.01.009
BindingDB Entry DOI: 10.7270/Q2CC12TS |
More data for this
Ligand-Target Pair | |
Dihydroorotate dehydrogenase (quinone), mitochondrial
(Homo sapiens (Human)) | BDBM50211947
(CHEMBL3901641)Show SMILES NCCO.COC(=O)c1cccc(CCCCc2c([nH]c(=O)[nH]c2=O)C(O)=O)c1 Show InChI InChI=1S/C17H18N2O6/c1-25-16(23)11-7-4-6-10(9-11)5-2-3-8-12-13(15(21)22)18-17(24)19-14(12)20/h4,6-7,9H,2-3,5,8H2,1H3,(H,21,22)(H2,18,19,20,24) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 7.35E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Nagasaki University
Curated by ChEMBL
| Assay Description
Inhibition of human dihydroorotate dehydrogenase assessed as reduction in orotate production using L-dihydroorotate as substrate measured after 20 mi... |
Bioorg Med Chem 25: 1465-1470 (2017)
Article DOI: 10.1016/j.bmc.2017.01.009
BindingDB Entry DOI: 10.7270/Q2CC12TS |
More data for this
Ligand-Target Pair | |
Dihydroorotate dehydrogenase (quinone), mitochondrial
(Homo sapiens (Human)) | BDBM50211697
(CHEMBL3981004)Show SMILES NCCO.NCCO.OC(=O)c1cccc2cc(CCCCc3c([nH]c(=O)[nH]c3=O)C(O)=O)ccc12 Show InChI InChI=1S/C20H18N2O6/c23-17-15(16(19(26)27)21-20(28)22-17)6-2-1-4-11-8-9-13-12(10-11)5-3-7-14(13)18(24)25/h3,5,7-10H,1-2,4,6H2,(H,24,25)(H,26,27)(H2,21,22,23,28) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| 7.60E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Nagasaki University
Curated by ChEMBL
| Assay Description
Inhibition of human dihydroorotate dehydrogenase assessed as reduction in orotate production using L-dihydroorotate as substrate measured after 20 mi... |
Bioorg Med Chem 25: 1465-1470 (2017)
Article DOI: 10.1016/j.bmc.2017.01.009
BindingDB Entry DOI: 10.7270/Q2CC12TS |
More data for this
Ligand-Target Pair | |
Dihydroorotate dehydrogenase (quinone), mitochondrial
(Homo sapiens (Human)) | BDBM50211696
(CHEMBL3956130)Show SMILES NCCO.COC(=O)c1ccccc1CCCCc1c([nH]c(=O)[nH]c1=O)C(O)=O Show InChI InChI=1S/C17H18N2O6/c1-25-16(23)11-8-4-2-6-10(11)7-3-5-9-12-13(15(21)22)18-17(24)19-14(12)20/h2,4,6,8H,3,5,7,9H2,1H3,(H,21,22)(H2,18,19,20,24) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| 1.02E+5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Nagasaki University
Curated by ChEMBL
| Assay Description
Inhibition of human dihydroorotate dehydrogenase assessed as reduction in orotate production using L-dihydroorotate as substrate measured after 20 mi... |
Bioorg Med Chem 25: 1465-1470 (2017)
Article DOI: 10.1016/j.bmc.2017.01.009
BindingDB Entry DOI: 10.7270/Q2CC12TS |
More data for this
Ligand-Target Pair | |
Dihydroorotate dehydrogenase (quinone), mitochondrial
(Homo sapiens (Human)) | BDBM50211692
(CHEMBL3944370)Show SMILES NCCO.NCCO.OC(=O)c1ccc(CCc2c([nH]c(=O)[nH]c2=O)C(O)=O)cc1 Show InChI InChI=1S/C14H12N2O6/c17-11-9(10(13(20)21)15-14(22)16-11)6-3-7-1-4-8(5-2-7)12(18)19/h1-2,4-5H,3,6H2,(H,18,19)(H,20,21)(H2,15,16,17,22) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
| Article
PubMed
| >1.25E+5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Nagasaki University
Curated by ChEMBL
| Assay Description
Inhibition of human dihydroorotate dehydrogenase assessed as reduction in orotate production using L-dihydroorotate as substrate measured after 20 mi... |
Bioorg Med Chem 25: 1465-1470 (2017)
Article DOI: 10.1016/j.bmc.2017.01.009
BindingDB Entry DOI: 10.7270/Q2CC12TS |
More data for this
Ligand-Target Pair | |
Dihydroorotate dehydrogenase (quinone), mitochondrial
(Homo sapiens (Human)) | BDBM50211694
(CHEMBL3917382)Show SMILES NCCO.COCOc1ccc2cc(CCc3c([nH]c(=O)[nH]c3=O)C(O)=O)ccc2c1 Show InChI InChI=1S/C19H18N2O6/c1-26-10-27-14-6-5-12-8-11(2-4-13(12)9-14)3-7-15-16(18(23)24)20-19(25)21-17(15)22/h2,4-6,8-9H,3,7,10H2,1H3,(H,23,24)(H2,20,21,22,25) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 1.39E+5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Nagasaki University
Curated by ChEMBL
| Assay Description
Inhibition of human dihydroorotate dehydrogenase assessed as reduction in orotate production using L-dihydroorotate as substrate measured after 20 mi... |
Bioorg Med Chem 25: 1465-1470 (2017)
Article DOI: 10.1016/j.bmc.2017.01.009
BindingDB Entry DOI: 10.7270/Q2CC12TS |
More data for this
Ligand-Target Pair | |
Dihydroorotate dehydrogenase (quinone), mitochondrial
(Homo sapiens (Human)) | BDBM50211745
(CHEMBL3899009)Show SMILES NCCO.OC(=O)c1[nH]c(=O)[nH]c(=O)c1CCc1cccc(c1)C(F)(F)F Show InChI InChI=1S/C14H11F3N2O4/c15-14(16,17)8-3-1-2-7(6-8)4-5-9-10(12(21)22)18-13(23)19-11(9)20/h1-3,6H,4-5H2,(H,21,22)(H2,18,19,20,23) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 1.42E+5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Nagasaki University
Curated by ChEMBL
| Assay Description
Inhibition of human dihydroorotate dehydrogenase assessed as reduction in orotate production using L-dihydroorotate as substrate measured after 20 mi... |
Bioorg Med Chem 25: 1465-1470 (2017)
Article DOI: 10.1016/j.bmc.2017.01.009
BindingDB Entry DOI: 10.7270/Q2CC12TS |
More data for this
Ligand-Target Pair | |
Dihydroorotate dehydrogenase (quinone), mitochondrial
(Homo sapiens (Human)) | BDBM50211732
(CHEMBL3908056)Show SMILES NCCO.Cc1cc(CCc2c([nH]c(=O)[nH]c2=O)C(O)=O)ccc1F Show InChI InChI=1S/C14H13FN2O4/c1-7-6-8(3-5-10(7)15)2-4-9-11(13(19)20)16-14(21)17-12(9)18/h3,5-6H,2,4H2,1H3,(H,19,20)(H2,16,17,18,21) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 1.47E+5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Nagasaki University
Curated by ChEMBL
| Assay Description
Inhibition of human dihydroorotate dehydrogenase assessed as reduction in orotate production using L-dihydroorotate as substrate measured after 20 mi... |
Bioorg Med Chem 25: 1465-1470 (2017)
Article DOI: 10.1016/j.bmc.2017.01.009
BindingDB Entry DOI: 10.7270/Q2CC12TS |
More data for this
Ligand-Target Pair | |
Dihydroorotate dehydrogenase (quinone), mitochondrial
(Homo sapiens (Human)) | BDBM50211707
(CHEMBL3947426)Show SMILES NCCO.CNC(=O)c1cccc2cc(CCc3c([nH]c(=O)[nH]c3=O)C(O)=O)ccc12 Show InChI InChI=1S/C19H17N3O5/c1-20-16(23)13-4-2-3-11-9-10(5-7-12(11)13)6-8-14-15(18(25)26)21-19(27)22-17(14)24/h2-5,7,9H,6,8H2,1H3,(H,20,23)(H,25,26)(H2,21,22,24,27) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 1.49E+5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Nagasaki University
Curated by ChEMBL
| Assay Description
Inhibition of human dihydroorotate dehydrogenase assessed as reduction in orotate production using L-dihydroorotate as substrate measured after 20 mi... |
Bioorg Med Chem 25: 1465-1470 (2017)
Article DOI: 10.1016/j.bmc.2017.01.009
BindingDB Entry DOI: 10.7270/Q2CC12TS |
More data for this
Ligand-Target Pair | |
Dihydroorotate dehydrogenase (quinone), mitochondrial
(Homo sapiens (Human)) | BDBM50211701
(CHEMBL3976207)Show SMILES NCCO.CC(C)(C)OC(=O)N1CCc2cc(CCc3c([nH]c(=O)[nH]c3=O)C(O)=O)ccc12 Show InChI InChI=1S/C20H23N3O6/c1-20(2,3)29-19(28)23-9-8-12-10-11(5-7-14(12)23)4-6-13-15(17(25)26)21-18(27)22-16(13)24/h5,7,10H,4,6,8-9H2,1-3H3,(H,25,26)(H2,21,22,24,27) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 1.95E+5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Nagasaki University
Curated by ChEMBL
| Assay Description
Inhibition of human dihydroorotate dehydrogenase assessed as reduction in orotate production using L-dihydroorotate as substrate measured after 20 mi... |
Bioorg Med Chem 25: 1465-1470 (2017)
Article DOI: 10.1016/j.bmc.2017.01.009
BindingDB Entry DOI: 10.7270/Q2CC12TS |
More data for this
Ligand-Target Pair | |
Dihydroorotate dehydrogenase (quinone), mitochondrial
(Homo sapiens (Human)) | BDBM50211948
(CHEMBL3929601)Show SMILES NCCO.COC(=O)c1ccc(CCCCc2c([nH]c(=O)[nH]c2=O)C(O)=O)cc1 Show InChI InChI=1S/C17H18N2O6/c1-25-16(23)11-8-6-10(7-9-11)4-2-3-5-12-13(15(21)22)18-17(24)19-14(12)20/h6-9H,2-5H2,1H3,(H,21,22)(H2,18,19,20,24) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 2.17E+5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Nagasaki University
Curated by ChEMBL
| Assay Description
Inhibition of human dihydroorotate dehydrogenase assessed as reduction in orotate production using L-dihydroorotate as substrate measured after 20 mi... |
Bioorg Med Chem 25: 1465-1470 (2017)
Article DOI: 10.1016/j.bmc.2017.01.009
BindingDB Entry DOI: 10.7270/Q2CC12TS |
More data for this
Ligand-Target Pair | |
Dihydroorotate dehydrogenase (quinone), mitochondrial
(Homo sapiens (Human)) | BDBM50211938
(CHEMBL3955618)Show SMILES NCCO.OC(=O)c1[nH]c(=O)[nH]c(=O)c1CCc1cccc2ccccc12 Show InChI InChI=1S/C17H14N2O4/c20-15-13(14(16(21)22)18-17(23)19-15)9-8-11-6-3-5-10-4-1-2-7-12(10)11/h1-7H,8-9H2,(H,21,22)(H2,18,19,20,23) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| 2.17E+5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Nagasaki University
Curated by ChEMBL
| Assay Description
Inhibition of human dihydroorotate dehydrogenase assessed as reduction in orotate production using L-dihydroorotate as substrate measured after 20 mi... |
Bioorg Med Chem 25: 1465-1470 (2017)
Article DOI: 10.1016/j.bmc.2017.01.009
BindingDB Entry DOI: 10.7270/Q2CC12TS |
More data for this
Ligand-Target Pair | |
Dihydroorotate dehydrogenase (quinone), mitochondrial
(Homo sapiens (Human)) | BDBM50211945
(CHEMBL3908653)Show SMILES NCCO.CCNC(=O)c1ccc2cc(CCc3c([nH]c(=O)[nH]c3=O)C(O)=O)ccc2c1 Show InChI InChI=1S/C20H19N3O5/c1-2-21-17(24)14-7-6-12-9-11(3-5-13(12)10-14)4-8-15-16(19(26)27)22-20(28)23-18(15)25/h3,5-7,9-10H,2,4,8H2,1H3,(H,21,24)(H,26,27)(H2,22,23,25,28) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
| Article
PubMed
| 2.36E+5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Nagasaki University
Curated by ChEMBL
| Assay Description
Inhibition of human dihydroorotate dehydrogenase assessed as reduction in orotate production using L-dihydroorotate as substrate measured after 20 mi... |
Bioorg Med Chem 25: 1465-1470 (2017)
Article DOI: 10.1016/j.bmc.2017.01.009
BindingDB Entry DOI: 10.7270/Q2CC12TS |
More data for this
Ligand-Target Pair | |
Dihydroorotate dehydrogenase (quinone), mitochondrial
(Homo sapiens (Human)) | BDBM50211730
(CHEMBL3920594)Show SMILES NCCO.CCc1ccc(CCc2c([nH]c(=O)[nH]c2=O)C(O)=O)cc1 Show InChI InChI=1S/C15H16N2O4/c1-2-9-3-5-10(6-4-9)7-8-11-12(14(19)20)16-15(21)17-13(11)18/h3-6H,2,7-8H2,1H3,(H,19,20)(H2,16,17,18,21) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 2.48E+5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Nagasaki University
Curated by ChEMBL
| Assay Description
Inhibition of human dihydroorotate dehydrogenase assessed as reduction in orotate production using L-dihydroorotate as substrate measured after 20 mi... |
Bioorg Med Chem 25: 1465-1470 (2017)
Article DOI: 10.1016/j.bmc.2017.01.009
BindingDB Entry DOI: 10.7270/Q2CC12TS |
More data for this
Ligand-Target Pair | |
Dihydroorotate dehydrogenase (quinone), mitochondrial
(Homo sapiens (Human)) | BDBM50211718
(CHEMBL3980064)Show SMILES NCCO.COC(=O)c1ccccc1-n1cc(nn1)-c1c([nH]c(=O)[nH]c1=O)C(O)=O Show InChI InChI=1S/C15H11N5O6/c1-26-14(24)7-4-2-3-5-9(7)20-6-8(18-19-20)10-11(13(22)23)16-15(25)17-12(10)21/h2-6H,1H3,(H,22,23)(H2,16,17,21,25) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| >2.50E+5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Nagasaki University
Curated by ChEMBL
| Assay Description
Inhibition of human dihydroorotate dehydrogenase assessed as reduction in orotate production using L-dihydroorotate as substrate measured after 20 mi... |
Bioorg Med Chem 25: 1465-1470 (2017)
Article DOI: 10.1016/j.bmc.2017.01.009
BindingDB Entry DOI: 10.7270/Q2CC12TS |
More data for this
Ligand-Target Pair | |
Dihydroorotate dehydrogenase (quinone), mitochondrial
(Homo sapiens (Human)) | BDBM50211720
(CHEMBL3942246)Show SMILES NCCO.OC(=O)c1[nH]c(=O)[nH]c(=O)c1CCc1ccc2cccc(NC(=O)c3ccccc3)c2c1 Show InChI InChI=1S/C24H19N3O5/c28-21(16-5-2-1-3-6-16)25-19-8-4-7-15-11-9-14(13-18(15)19)10-12-17-20(23(30)31)26-24(32)27-22(17)29/h1-9,11,13H,10,12H2,(H,25,28)(H,30,31)(H2,26,27,29,32) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| 2.62E+5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Nagasaki University
Curated by ChEMBL
| Assay Description
Inhibition of human dihydroorotate dehydrogenase assessed as reduction in orotate production using L-dihydroorotate as substrate measured after 20 mi... |
Bioorg Med Chem 25: 1465-1470 (2017)
Article DOI: 10.1016/j.bmc.2017.01.009
BindingDB Entry DOI: 10.7270/Q2CC12TS |
More data for this
Ligand-Target Pair | |
Dihydroorotate dehydrogenase (quinone), mitochondrial
(Homo sapiens (Human)) | BDBM50211728
(CHEMBL3909905)Show SMILES NCCO.CN(C)c1cccc2c(cccc12)S(=O)(=O)NCCCc1c([nH]c(=O)[nH]c1=O)C(O)=O Show InChI InChI=1S/C20H22N4O6S/c1-24(2)15-9-3-7-13-12(15)6-4-10-16(13)31(29,30)21-11-5-8-14-17(19(26)27)22-20(28)23-18(14)25/h3-4,6-7,9-10,21H,5,8,11H2,1-2H3,(H,26,27)(H2,22,23,25,28) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
MMDB
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| >3.13E+5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Nagasaki University
Curated by ChEMBL
| Assay Description
Inhibition of human dihydroorotate dehydrogenase assessed as reduction in orotate production using L-dihydroorotate as substrate measured after 20 mi... |
Bioorg Med Chem 25: 1465-1470 (2017)
Article DOI: 10.1016/j.bmc.2017.01.009
BindingDB Entry DOI: 10.7270/Q2CC12TS |
More data for this
Ligand-Target Pair | |
Dihydroorotate dehydrogenase (quinone), mitochondrial
(Homo sapiens (Human)) | BDBM50211724
(CHEMBL3960872)Show SMILES NCCO.OC(=O)c1[nH]c(=O)[nH]c(=O)c1CCCNC(=O)c1ccccc1 Show InChI InChI=1S/C15H15N3O5/c19-12(9-5-2-1-3-6-9)16-8-4-7-10-11(14(21)22)17-15(23)18-13(10)20/h1-3,5-6H,4,7-8H2,(H,16,19)(H,21,22)(H2,17,18,20,23) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| >3.13E+5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Nagasaki University
Curated by ChEMBL
| Assay Description
Inhibition of human dihydroorotate dehydrogenase assessed as reduction in orotate production using L-dihydroorotate as substrate measured after 20 mi... |
Bioorg Med Chem 25: 1465-1470 (2017)
Article DOI: 10.1016/j.bmc.2017.01.009
BindingDB Entry DOI: 10.7270/Q2CC12TS |
More data for this
Ligand-Target Pair | |
Dihydroorotate dehydrogenase (quinone), mitochondrial
(Homo sapiens (Human)) | BDBM50211950
(CHEMBL3891863)Show InChI InChI=1S/C8H11N3O4/c9-3-1-2-4-5(7(13)14)10-8(15)11-6(4)12/h1-3,9H2,(H,13,14)(H2,10,11,12,15) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| >3.13E+5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Nagasaki University
Curated by ChEMBL
| Assay Description
Inhibition of human dihydroorotate dehydrogenase assessed as reduction in orotate production using L-dihydroorotate as substrate measured after 20 mi... |
Bioorg Med Chem 25: 1465-1470 (2017)
Article DOI: 10.1016/j.bmc.2017.01.009
BindingDB Entry DOI: 10.7270/Q2CC12TS |
More data for this
Ligand-Target Pair | |
Dihydroorotate dehydrogenase (quinone), mitochondrial
(Homo sapiens (Human)) | BDBM50211949
(CHEMBL3952177)Show SMILES NCCO.CC(C)(C)OC(=O)NCCCc1c([nH]c(=O)[nH]c1=O)C(O)=O Show InChI InChI=1S/C13H19N3O6/c1-13(2,3)22-12(21)14-6-4-5-7-8(10(18)19)15-11(20)16-9(7)17/h4-6H2,1-3H3,(H,14,21)(H,18,19)(H2,15,16,17,20) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| >3.13E+5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Nagasaki University
Curated by ChEMBL
| Assay Description
Inhibition of human dihydroorotate dehydrogenase assessed as reduction in orotate production using L-dihydroorotate as substrate measured after 20 mi... |
Bioorg Med Chem 25: 1465-1470 (2017)
Article DOI: 10.1016/j.bmc.2017.01.009
BindingDB Entry DOI: 10.7270/Q2CC12TS |
More data for this
Ligand-Target Pair | |
Dihydroorotate dehydrogenase (quinone), mitochondrial
(Homo sapiens (Human)) | BDBM50211708
(CHEMBL3910672)Show SMILES NCCO.NCCO.OC(=O)c1ccccc1CCCCc1c([nH]c(=O)[nH]c1=O)C(O)=O Show InChI InChI=1S/C16H16N2O6/c19-13-11(12(15(22)23)17-16(24)18-13)8-4-2-6-9-5-1-3-7-10(9)14(20)21/h1,3,5,7H,2,4,6,8H2,(H,20,21)(H,22,23)(H2,17,18,19,24) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| 3.19E+5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Nagasaki University
Curated by ChEMBL
| Assay Description
Inhibition of human dihydroorotate dehydrogenase assessed as reduction in orotate production using L-dihydroorotate as substrate measured after 20 mi... |
Bioorg Med Chem 25: 1465-1470 (2017)
Article DOI: 10.1016/j.bmc.2017.01.009
BindingDB Entry DOI: 10.7270/Q2CC12TS |
More data for this
Ligand-Target Pair | |
Dihydroorotate dehydrogenase (quinone), mitochondrial
(Homo sapiens (Human)) | BDBM50211962
(CHEMBL3897952)Show SMILES NCCO.OC(=O)c1[nH]c(=O)[nH]c(=O)c1CCc1ccc(cc1)C(F)(F)F Show InChI InChI=1S/C14H11F3N2O4/c15-14(16,17)8-4-1-7(2-5-8)3-6-9-10(12(21)22)18-13(23)19-11(9)20/h1-2,4-5H,3,6H2,(H,21,22)(H2,18,19,20,23) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 3.60E+5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Nagasaki University
Curated by ChEMBL
| Assay Description
Inhibition of human dihydroorotate dehydrogenase assessed as reduction in orotate production using L-dihydroorotate as substrate measured after 20 mi... |
Bioorg Med Chem 25: 1465-1470 (2017)
Article DOI: 10.1016/j.bmc.2017.01.009
BindingDB Entry DOI: 10.7270/Q2CC12TS |
More data for this
Ligand-Target Pair | |
Dihydroorotate dehydrogenase (quinone), mitochondrial
(Homo sapiens (Human)) | BDBM50211700
(CHEMBL3898445)Show SMILES NCCO.COC(=O)c1cccc(CCc2c([nH]c(=O)[nH]c2=O)C(O)=O)c1 Show InChI InChI=1S/C15H14N2O6/c1-23-14(21)9-4-2-3-8(7-9)5-6-10-11(13(19)20)16-15(22)17-12(10)18/h2-4,7H,5-6H2,1H3,(H,19,20)(H2,16,17,18,22) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| 3.82E+5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Nagasaki University
Curated by ChEMBL
| Assay Description
Inhibition of human dihydroorotate dehydrogenase assessed as reduction in orotate production using L-dihydroorotate as substrate measured after 20 mi... |
Bioorg Med Chem 25: 1465-1470 (2017)
Article DOI: 10.1016/j.bmc.2017.01.009
BindingDB Entry DOI: 10.7270/Q2CC12TS |
More data for this
Ligand-Target Pair | |
Dihydroorotate dehydrogenase (quinone), mitochondrial
(Homo sapiens (Human)) | BDBM50211729
(CHEMBL3927463)Show SMILES NCCO.COC(=O)c1ccc(cc1)-n1cc(nn1)-c1c([nH]c(=O)[nH]c1=O)C(O)=O Show InChI InChI=1S/C15H11N5O6/c1-26-14(24)7-2-4-8(5-3-7)20-6-9(18-19-20)10-11(13(22)23)16-15(25)17-12(10)21/h2-6H,1H3,(H,22,23)(H2,16,17,21,25) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 4.20E+5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Nagasaki University
Curated by ChEMBL
| Assay Description
Inhibition of human dihydroorotate dehydrogenase assessed as reduction in orotate production using L-dihydroorotate as substrate measured after 20 mi... |
Bioorg Med Chem 25: 1465-1470 (2017)
Article DOI: 10.1016/j.bmc.2017.01.009
BindingDB Entry DOI: 10.7270/Q2CC12TS |
More data for this
Ligand-Target Pair | |
Dihydroorotate dehydrogenase (quinone), mitochondrial
(Homo sapiens (Human)) | BDBM50211955
(CHEMBL3978933)Show SMILES NCCO.COc1cccc(CCc2c([nH]c(=O)[nH]c2=O)C(O)=O)c1 Show InChI InChI=1S/C14H14N2O5/c1-21-9-4-2-3-8(7-9)5-6-10-11(13(18)19)15-14(20)16-12(10)17/h2-4,7H,5-6H2,1H3,(H,18,19)(H2,15,16,17,20) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 4.84E+5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Nagasaki University
Curated by ChEMBL
| Assay Description
Inhibition of human dihydroorotate dehydrogenase assessed as reduction in orotate production using L-dihydroorotate as substrate measured after 20 mi... |
Bioorg Med Chem 25: 1465-1470 (2017)
Article DOI: 10.1016/j.bmc.2017.01.009
BindingDB Entry DOI: 10.7270/Q2CC12TS |
More data for this
Ligand-Target Pair | |
Dihydroorotate dehydrogenase (quinone), mitochondrial
(Homo sapiens (Human)) | BDBM50211704
(CHEMBL3967690)Show SMILES NCCO.NC(=O)c1ccc(CCc2c([nH]c(=O)[nH]c2=O)C(O)=O)cc1 Show InChI InChI=1S/C14H13N3O5/c15-11(18)8-4-1-7(2-5-8)3-6-9-10(13(20)21)16-14(22)17-12(9)19/h1-2,4-5H,3,6H2,(H2,15,18)(H,20,21)(H2,16,17,19,22) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| >5.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Nagasaki University
Curated by ChEMBL
| Assay Description
Inhibition of human dihydroorotate dehydrogenase assessed as reduction in orotate production using L-dihydroorotate as substrate measured after 20 mi... |
Bioorg Med Chem 25: 1465-1470 (2017)
Article DOI: 10.1016/j.bmc.2017.01.009
BindingDB Entry DOI: 10.7270/Q2CC12TS |
More data for this
Ligand-Target Pair | |
Dihydroorotate dehydrogenase (quinone), mitochondrial
(Homo sapiens (Human)) | BDBM50211711
(CHEMBL3916433)Show SMILES NCCO.NC(=O)c1cccc(CCc2c([nH]c(=O)[nH]c2=O)C(O)=O)c1 Show InChI InChI=1S/C14H13N3O5/c15-11(18)8-3-1-2-7(6-8)4-5-9-10(13(20)21)16-14(22)17-12(9)19/h1-3,6H,4-5H2,(H2,15,18)(H,20,21)(H2,16,17,19,22) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| >5.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Nagasaki University
Curated by ChEMBL
| Assay Description
Inhibition of human dihydroorotate dehydrogenase assessed as reduction in orotate production using L-dihydroorotate as substrate measured after 20 mi... |
Bioorg Med Chem 25: 1465-1470 (2017)
Article DOI: 10.1016/j.bmc.2017.01.009
BindingDB Entry DOI: 10.7270/Q2CC12TS |
More data for this
Ligand-Target Pair | |
Dihydroorotate dehydrogenase (quinone), mitochondrial
(Homo sapiens (Human)) | BDBM50211946
(CHEMBL3919626)Show SMILES NCCO.OCCNC(=O)c1ccc2cc(CCc3c([nH]c(=O)[nH]c3=O)C(O)=O)ccc2c1 Show InChI InChI=1S/C20H19N3O6/c24-8-7-21-17(25)14-5-4-12-9-11(1-3-13(12)10-14)2-6-15-16(19(27)28)22-20(29)23-18(15)26/h1,3-5,9-10,24H,2,6-8H2,(H,21,25)(H,27,28)(H2,22,23,26,29) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| >5.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Nagasaki University
Curated by ChEMBL
| Assay Description
Inhibition of human dihydroorotate dehydrogenase assessed as reduction in orotate production using L-dihydroorotate as substrate measured after 20 mi... |
Bioorg Med Chem 25: 1465-1470 (2017)
Article DOI: 10.1016/j.bmc.2017.01.009
BindingDB Entry DOI: 10.7270/Q2CC12TS |
More data for this
Ligand-Target Pair | |
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