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Assay Detail

CHEMBL5044068

Review assay metadata, readout intent, target linkage, and publication context from the same page.

Binding
Inhibition of human recombinant DHODH expressed in Escherichia coli BL21 (DE3) using dihydroorotate as substrate and CoQ6 as co-substrate incubated for 10 mins by DCIP based multimode microplate reader analysis
43
Total Activities
43
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type Binding
Organism Homo sapiens
Confidence 9 — Direct single protein target
Curated By Autocuration

Target

Dihydroorotate dehydrogenase (quinone), mitochondrial (CHEMBL1966)
Type SINGLE PROTEIN
Organism Homo sapiens

Publication

Discovery of Orally Available Retinoic Acid Receptor-Related Orphan Receptor γ-t/Dihydroorotate Dehydrogenase Dual Inhibitors for the Treatment of Refractory Inflammatory Bowel Disease.
Chen JA, Ma H, Liu Z, Tian J, Lu S, Fang W, Ze S, Lu W, Xie Q, Huang J, Wang Y.
J Med Chem (2022) 65 : 592 -615
PubMed 34957834 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 43 5.76 6.80

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL5085951 1 6.80
CHEMBL5086318 1 6.76
CHEMBL973 TERIFLUNOMIDE 4.0 1 6.64
CHEMBL5093830 1 6.53
CHEMBL5092142 1 6.44
CHEMBL5075214 1 6.37
CHEMBL5080135 1 6.24
CHEMBL5086624 1 6.23
CHEMBL5074809 1 6.14
CHEMBL5082345 1 6.10
CHEMBL5087043 1 5.99
CHEMBL5080090 1 5.98
CHEMBL5075048 1 5.94
CHEMBL5075372 1 5.85
CHEMBL5091053 1 5.67
CHEMBL5075277 1 5.63
CHEMBL5079972 1 5.57
CHEMBL5089276 1 5.34
CHEMBL5070273 1 5.33
CHEMBL5071971 1 5.22
CHEMBL5087158 1 5.12
CHEMBL5076141 1 5.07
CHEMBL5082516 1 5.03
CHEMBL5084708 1 4.95
CHEMBL5075241 1 4.92
CHEMBL5079686 1 4.86
CHEMBL5079868 1 4.69
CHEMBL5082633 1 -
CHEMBL5079945 1 -
CHEMBL5091280 1 -

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL5085951 IC50 = 159.0 nM 6.80
CHEMBL5086318 IC50 = 172.0 nM 6.76
CHEMBL973 TERIFLUNOMIDE IC50 = 227.0 nM 6.64
CHEMBL5093830 IC50 = 297.0 nM 6.53
CHEMBL5092142 IC50 = 363.0 nM 6.44
CHEMBL5075214 IC50 = 432.0 nM 6.37
CHEMBL5080135 IC50 = 573.0 nM 6.24
CHEMBL5086624 IC50 = 588.0 nM 6.23
CHEMBL5074809 IC50 = 730.0 nM 6.14
CHEMBL5082345 IC50 = 794.0 nM 6.10
CHEMBL5087043 IC50 = 1020.0 nM 5.99
CHEMBL5080090 IC50 = 1040.0 nM 5.98
CHEMBL5075048 IC50 = 1150.0 nM 5.94
CHEMBL5075372 IC50 = 1410.0 nM 5.85
CHEMBL5091053 IC50 = 2150.0 nM 5.67
CHEMBL5075277 IC50 = 2350.0 nM 5.63
CHEMBL5079972 IC50 = 2670.0 nM 5.57
CHEMBL5089276 IC50 = 4520.0 nM 5.34
CHEMBL5070273 IC50 = 4680.0 nM 5.33
CHEMBL5071971 IC50 = 6080.0 nM 5.22
CHEMBL5087158 IC50 = 7550.0 nM 5.12
CHEMBL5076141 IC50 = 8430.0 nM 5.07
CHEMBL5082516 IC50 = 9320.0 nM 5.03
CHEMBL5084708 IC50 = 11300.0 nM 4.95
CHEMBL5075241 IC50 = 12100.0 nM 4.92
CHEMBL5079686 IC50 = 13900.0 nM 4.86
CHEMBL5079868 IC50 = 20300.0 nM 4.69
CHEMBL5087808 IC50 - -
CHEMBL3609408 IC50 - -
CHEMBL62136 T091317 IC50 - -
CHEMBL5091602 IC50 - -
CHEMBL5074291 IC50 - -
CHEMBL5091987 IC50 - -
CHEMBL5083524 IC50 - -
CHEMBL5072854 IC50 - -
CHEMBL5085812 IC50 - -
CHEMBL5079969 IC50 - -
CHEMBL5080847 IC50 - -
CHEMBL5089480 IC50 - -
CHEMBL5079282 IC50 - -
CHEMBL5091280 IC50 - -
CHEMBL5079945 IC50 - -
CHEMBL5082633 IC50 - -