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Assay Detail

CHEMBL5346522

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

Binding
Inhibition of human DHODH in MOLM-13 AML cells
24
Total Activities
24
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type Binding
Organism Homo sapiens
Cell Type MOLM-13
Confidence 9 — Direct single protein target
Curated By Autocuration

Target

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

Publication

Discovery of Alternative Binding Poses through Fragment-Based Identification of DHODH Inhibitors.
DeRatt LG, Pietsch EC, Cisar JS, Jacoby E, Kazmi F, Matico R, Shaffer P, Tanner A, Wang W, Attar R, Edwards JP, Kuduk SD.
ACS Med Chem Lett (2024) 15 : 381 -387
PubMed 38505861 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 24 7.88 9.62

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL5180161 1 9.62
CHEMBL5193821 1 9.52
CHEMBL5419877 1 8.85
CHEMBL5409064 1 8.64
CHEMBL5409267 1 8.62
CHEMBL5407738 1 8.55
CHEMBL5428012 1 8.46
CHEMBL5407486 1 8.42
CHEMBL5405721 1 8.40
CHEMBL5398296 1 8.39
CHEMBL5432814 1 8.27
CHEMBL5421552 1 8.22
CHEMBL5427450 1 8.05
CHEMBL5399532 1 7.89
CHEMBL5439442 1 7.52
CHEMBL5423878 1 7.40
CHEMBL5403590 1 7.32
CHEMBL5439460 1 7.24
CHEMBL5395154 1 7.00
CHEMBL5399005 1 7.00
CHEMBL5404114 1 6.80
CHEMBL5421173 1 6.65
CHEMBL5426062 1 6.22
CHEMBL5393795 1 5.98

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL5180161 IC50 = 0.24 nM 9.62
CHEMBL5193821 IC50 = 0.3 nM 9.52
CHEMBL5419877 IC50 = 1.4 nM 8.85
CHEMBL5409064 IC50 = 2.3 nM 8.64
CHEMBL5409267 IC50 = 2.4 nM 8.62
CHEMBL5407738 IC50 = 2.8 nM 8.55
CHEMBL5428012 IC50 = 3.5 nM 8.46
CHEMBL5407486 IC50 = 3.8 nM 8.42
CHEMBL5405721 IC50 = 4.0 nM 8.40
CHEMBL5398296 IC50 = 4.1 nM 8.39
CHEMBL5432814 IC50 = 5.4 nM 8.27
CHEMBL5421552 IC50 = 6.0 nM 8.22
CHEMBL5427450 IC50 = 9.0 nM 8.05
CHEMBL5399532 IC50 = 13.0 nM 7.89
CHEMBL5439442 IC50 = 30.0 nM 7.52
CHEMBL5423878 IC50 = 40.0 nM 7.40
CHEMBL5403590 IC50 = 48.0 nM 7.32
CHEMBL5439460 IC50 = 57.0 nM 7.24
CHEMBL5395154 IC50 = 100.0 nM 7.00
CHEMBL5399005 IC50 = 100.0 nM 7.00
CHEMBL5404114 IC50 = 158.0 nM 6.80
CHEMBL5421173 IC50 = 226.0 nM 6.65
CHEMBL5426062 IC50 = 601.0 nM 6.22
CHEMBL5393795 IC50 = 1040.0 nM 5.98