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Assay Detail

CHEMBL4810784

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

Binding
Inhibition of IDO1 in human HeLa cells assessed as production of N-formylkynurenine using tryptophan as substrate in presence of inactivated fetal bovine serum
42
Total Activities
13
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

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

Target

Indoleamine 2,3-dioxygenase 1 (CHEMBL4685)
Type SINGLE PROTEIN
Organism Homo sapiens

Publication

Discovery of IDO1 inhibitors containing a decahydroquinoline, decahydro-1,6-naphthyridine, or octahydro-1H-pyrrolo[3,2-c]pyridine scaffold.
Yu W, Deng Y, Sloman D, Li D, Liu K, Fradera X, Lesburg CA, Martinot T, Doty A, Ferguson H, Richard Miller J, Knemeyer I, Otte K, Vincent S, Sciammetta N, Jonathan Bennett D, Han Y.
Bioorg Med Chem Lett (2021) 49 : 128314 -128314
PubMed 34391891 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 42 7.92 9.00

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL4855797 4 9.00
CHEMBL4858599 4 8.82
CHEMBL4848630 4 8.80
CHEMBL4863767 4 8.72
CHEMBL4848366 4 8.72
CHEMBL4852537 2 8.70
CHEMBL4849622 4 8.62
CHEMBL4853448 4 8.54
CHEMBL4847151 4 8.44
CHEMBL4861395 1 8.41
CHEMBL4849825 4 7.96
CHEMBL3545369 EPACADOSTAT 3.0 1 7.90
CHEMBL4857208 2 5.98

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL4855797 IC50 = 1.0 nM 9.00
CHEMBL4858599 IC50 = 1.5 nM 8.82
CHEMBL4848630 IC50 = 1.6 nM 8.80
CHEMBL4848366 IC50 = 1.9 nM 8.72
CHEMBL4863767 IC50 = 1.9 nM 8.72
CHEMBL4863767 IC50 = 1.9 nM 8.72
CHEMBL4855797 IC50 = 1.9 nM 8.72
CHEMBL4852537 IC50 = 2.0 nM 8.70
CHEMBL4855797 IC50 = 2.1 nM 8.68
CHEMBL4855797 IC50 = 2.3 nM 8.64
CHEMBL4849622 IC50 = 2.4 nM 8.62
CHEMBL4863767 IC50 = 2.6 nM 8.59
CHEMBL4853448 IC50 = 2.9 nM 8.54
CHEMBL4849622 IC50 = 3.0 nM 8.52
CHEMBL4863767 IC50 = 3.2 nM 8.49
CHEMBL4847151 IC50 = 3.6 nM 8.44
CHEMBL4848366 IC50 = 3.7 nM 8.43
CHEMBL4861395 IC50 = 3.9 nM 8.41
CHEMBL4852537 IC50 = 3.9 nM 8.41
CHEMBL4848630 IC50 = 4.2 nM 8.38
CHEMBL4848630 IC50 = 5.2 nM 8.28
CHEMBL4847151 IC50 = 5.4 nM 8.27
CHEMBL4849622 IC50 = 7.0 nM 8.15
CHEMBL4848366 IC50 = 9.1 nM 8.04
CHEMBL4849825 IC50 = 11.0 nM 7.96
CHEMBL4853448 IC50 = 12.0 nM 7.92
CHEMBL3545369 EPACADOSTAT IC50 = 12.5 nM 7.90
CHEMBL4849622 IC50 = 14.0 nM 7.85
CHEMBL4847151 IC50 = 15.0 nM 7.82
CHEMBL4849825 IC50 = 16.0 nM 7.80
CHEMBL4858599 IC50 = 19.0 nM 7.72
CHEMBL4848366 IC50 = 32.0 nM 7.50
CHEMBL4848630 IC50 = 32.0 nM 7.50
CHEMBL4853448 IC50 = 40.0 nM 7.40
CHEMBL4858599 IC50 = 107.0 nM 6.97
CHEMBL4858599 IC50 = 115.0 nM 6.94
CHEMBL4849825 IC50 = 184.0 nM 6.74
CHEMBL4853448 IC50 = 302.0 nM 6.52
CHEMBL4847151 IC50 = 430.0 nM 6.37
CHEMBL4857208 IC50 = 1052.0 nM 5.98
CHEMBL4849825 IC50 = 1149.0 nM 5.94
CHEMBL4857208 IC50 = 27702.0 nM 4.56