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Assay Detail

CHEMBL863918

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

Binding
Binding affinity to human DHODH
12
Total Activities
6
Compounds Tested
3
Activity Types
0
Assay Parameters

Assay Information

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

Target

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

Publication

The first de novo designed inhibitors of Plasmodium falciparum dihydroorotate dehydrogenase.
Heikkilä T, Thirumalairajan S, Davies M, Parsons MR, McConkey AG, Fishwick CW, Johnson AP.
Bioorg Med Chem Lett (2006) 16 : 88 -92
PubMed 16236496 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 6 5.08 5.30
Ki app 3 - -
Ki 3 5.96 6.16

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL370865 2 6.16
CHEMBL199574 2 5.96
CHEMBL200536 2 5.75
CHEMBL199572 2 -
CHEMBL199575 2 -
CHEMBL372561 2 -

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL370865 Ki = 700.0 nM 6.16
CHEMBL199574 Ki = 1100.0 nM 5.96
CHEMBL200536 Ki = 1800.0 nM 5.75
CHEMBL370865 IC50 = 5000.0 nM 5.30
CHEMBL199574 IC50 = 8400.0 nM 5.08
CHEMBL200536 IC50 = 13800.0 nM 4.86
CHEMBL199572 IC50 > 200000.0 nM -
CHEMBL199572 Ki app - -
CHEMBL199575 IC50 > 200000.0 nM -
CHEMBL199575 Ki app - -
CHEMBL372561 IC50 > 200000.0 nM -
CHEMBL372561 Ki app - -