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Assay Detail

CHEMBL984852

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

Binding
Inhibition of ubiquinone binding site of human dihydroorotate dehydrogenase
34
Total Activities
17
Compounds Tested
2
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

Structure-based design, synthesis, and characterization of inhibitors of human and Plasmodium falciparum dihydroorotate dehydrogenases.
Davies M, Heikkilä T, McConkey GA, Fishwick CW, Parsons MR, Johnson AP.
J Med Chem (2009) 52 : 2683 -2693
PubMed 19351152 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
Ki 17 7.41 8.57
IC50 17 6.50 7.66

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL484780 2 8.57
CHEMBL142996 2 8.15
CHEMBL519160 2 7.96
CHEMBL141732 2 7.85
CHEMBL483995 2 7.80
CHEMBL484531 2 7.80
CHEMBL520306 2 7.68
CHEMBL483552 2 7.66
CHEMBL520008 2 7.64
CHEMBL505315 2 7.60
CHEMBL483161 2 7.60
CHEMBL973 TERIFLUNOMIDE 4.0 2 7.50
CHEMBL483994 2 7.41
CHEMBL520999 2 7.40
CHEMBL484595 2 6.72
CHEMBL484594 2 5.70
CHEMBL484602 2 4.97

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL484780 Ki = 2.7 nM 8.57
CHEMBL142996 Ki = 7.0 nM 8.15
CHEMBL519160 Ki = 11.0 nM 7.96
CHEMBL141732 Ki = 14.0 nM 7.85
CHEMBL483995 Ki = 16.0 nM 7.80
CHEMBL484531 Ki = 16.0 nM 7.80
CHEMBL520306 Ki = 21.0 nM 7.68
CHEMBL484780 IC50 = 22.0 nM 7.66
CHEMBL483552 Ki = 22.0 nM 7.66
CHEMBL520008 Ki = 23.0 nM 7.64
CHEMBL505315 Ki = 25.0 nM 7.60
CHEMBL483161 Ki = 25.0 nM 7.60
CHEMBL973 TERIFLUNOMIDE Ki = 32.0 nM 7.50
CHEMBL483994 Ki = 39.0 nM 7.41
CHEMBL520999 Ki = 40.0 nM 7.40
CHEMBL142996 IC50 = 53.0 nM 7.28
CHEMBL519160 IC50 = 90.0 nM 7.05
CHEMBL141732 IC50 = 117.0 nM 6.93
CHEMBL483995 IC50 = 130.0 nM 6.89
CHEMBL484531 IC50 = 130.0 nM 6.89
CHEMBL520306 IC50 = 170.0 nM 6.77
CHEMBL483552 IC50 = 180.0 nM 6.75
CHEMBL484595 Ki = 190.0 nM 6.72
CHEMBL520008 IC50 = 190.0 nM 6.72
CHEMBL505315 IC50 = 200.0 nM 6.70
CHEMBL483161 IC50 = 200.0 nM 6.70
CHEMBL973 TERIFLUNOMIDE IC50 = 261.0 nM 6.58
CHEMBL483994 IC50 = 320.0 nM 6.50
CHEMBL520999 IC50 = 330.0 nM 6.48
CHEMBL484595 IC50 = 1520.0 nM 5.82
CHEMBL484594 Ki = 2000.0 nM 5.70
CHEMBL484602 Ki = 10700.0 nM 4.97
CHEMBL484594 IC50 = 16500.0 nM 4.78
CHEMBL484602 IC50 = 86600.0 nM 4.06