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Assay Detail

CHEMBL4359028

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

Binding
Inhibition of IDO1 in IFNgamma-stimulated human A375 cells assessed as reduction in L-Kyn level measured after 48 hrs by HPLC analysis
13
Total Activities
13
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type Binding
Organism Homo sapiens
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 Highly Potent Benzimidazole Derivatives as Indoleamine 2,3-Dioxygenase-1 (IDO1) Inhibitors: From Structure-Based Virtual Screening to in Vivo Pharmacodynamic Activity.
Serafini M, Torre E, Aprile S, Grosso ED, Gesù A, Griglio A, Colombo G, Travelli C, Paiella S, Adamo A, Orecchini E, Coletti A, Pallotta MT, Ugel S, Massarotti A, Pirali T, Fallarini S.
J Med Chem (2020) 63 : 3047 -3065
PubMed 32150677 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 13 6.82 8.11

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL3545369 EPACADOSTAT 3.0 1 8.11
CHEMBL4557994 1 7.80
CHEMBL4571131 1 7.72
CHEMBL4448402 1 7.14
CHEMBL4458549 1 7.05
CHEMBL4466117 1 6.87
CHEMBL4531545 1 6.49
CHEMBL4472707 1 6.39
CHEMBL4588288 1 6.38
CHEMBL4451614 1 6.32
CHEMBL4443904 1 6.20
CHEMBL4439258 1 6.11
CHEMBL4457663 1 6.02

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL3545369 EPACADOSTAT IC50 = 7.7 nM 8.11
CHEMBL4557994 IC50 = 16.0 nM 7.80
CHEMBL4571131 IC50 = 19.0 nM 7.72
CHEMBL4448402 IC50 = 72.0 nM 7.14
CHEMBL4458549 IC50 = 90.0 nM 7.05
CHEMBL4466117 IC50 = 134.0 nM 6.87
CHEMBL4531545 IC50 = 327.0 nM 6.49
CHEMBL4472707 IC50 = 407.0 nM 6.39
CHEMBL4588288 IC50 = 413.0 nM 6.38
CHEMBL4451614 IC50 = 477.0 nM 6.32
CHEMBL4443904 IC50 = 636.0 nM 6.20
CHEMBL4439258 IC50 = 781.0 nM 6.11
CHEMBL4457663 IC50 = 961.0 nM 6.02