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Assay Detail

CHEMBL4605759

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

Binding
Inhibition of heme binding to IDO1 in interferon-gamma-induced human HeLa cells assessed as reduction in N-formylkynurenine production using L-tryptophan as substrate incubated for 48 hrs by fluorescence based assay
12
Total Activities
12
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

Strategic Incorporation of Polarity in Heme-Displacing Inhibitors of Indoleamine-2,3-dioxygenase-1 (IDO1).
White C, McGowan MA, Zhou H, Sciammetta N, Fradera X, Lim J, Joshi EM, Andrews C, Nickbarg EB, Cowley P, Trewick S, Augustin M, von Köenig K, Lesburg CA, Otte K, Knemeyer I, Woo H, Yu W, Cheng M, Spacciapoli P, Geda P, Song X, Smotrov N, Curran P, Heo MR, Abeywickrema P, Miller JR, Bennett DJ, Han Y.
ACS Med Chem Lett (2020) 11 : 550 -557
PubMed 32292563 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 12 7.95 8.77

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL4638223 1 8.77
CHEMBL4645108 1 8.68
CHEMBL4635112 1 8.57
CHEMBL4632601 1 8.49
CHEMBL4633874 1 8.44
CHEMBL4637907 1 8.08
CHEMBL4636709 1 8.04
CHEMBL4645220 1 7.77
CHEMBL4648885 1 7.72
CHEMBL4643572 1 7.50
CHEMBL4637454 1 5.42
CHEMBL4632911 1 -

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL4638223 IC50 = 1.7 nM 8.77
CHEMBL4645108 IC50 = 2.1 nM 8.68
CHEMBL4635112 IC50 = 2.7 nM 8.57
CHEMBL4632601 IC50 = 3.2 nM 8.49
CHEMBL4633874 IC50 = 3.6 nM 8.44
CHEMBL4637907 IC50 = 8.3 nM 8.08
CHEMBL4636709 IC50 = 9.2 nM 8.04
CHEMBL4645220 IC50 = 17.0 nM 7.77
CHEMBL4648885 IC50 = 19.0 nM 7.72
CHEMBL4643572 IC50 = 32.0 nM 7.50
CHEMBL4637454 IC50 = 3800.0 nM 5.42
CHEMBL4632911 IC50 > 10000.0 nM -