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Assay Detail

CHEMBL5045882

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

Binding
Inhibition of oxidative phosphorylation complex I in human MIA PaCa-2 cells assessed as reduction in NAD+/NADH ratio incubated for 48 hrs in glucose-containing medium by NAD/NADH-Glo assay
5
Total Activities
5
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type Binding
Organism Homo sapiens
Cell Type MIA PaCa-2
Confidence 0 — Uncurated / Unknown
Curated By Autocuration

Target

Unchecked (CHEMBL612545)
Type UNCHECKED

Publication

Multiparameter Optimization of Oxidative Phosphorylation Inhibitors for the Treatment of Pancreatic Cancer.
Xue D, Xu Y, Kyani A, Roy J, Dai L, Sun D, Neamati N.
J Med Chem (2022) 65 : 3404 -3419
PubMed 35167303 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 5 7.84 8.49

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL5082384 1 8.49
CHEMBL5091697 1 8.44
CHEMBL5070213 1 7.64
CHEMBL5076092 1 7.47
CHEMBL5087697 1 7.17

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL5082384 IC50 = 3.2 nM 8.49
CHEMBL5091697 IC50 = 3.6 nM 8.44
CHEMBL5070213 IC50 = 23.0 nM 7.64
CHEMBL5076092 IC50 = 34.0 nM 7.47
CHEMBL5087697 IC50 = 67.5 nM 7.17