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Assay Detail

CHEMBL5364590

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

Binding
Inhibition of SARS-CoV-2 main protease
3
Total Activities
3
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type Binding
Organism Severe acute respiratory syndrome coronavirus 2
Confidence 9 — Direct single protein target
Curated By Autocuration

Target

Replicase polyprotein 1ab (CHEMBL4523582)
Type SINGLE PROTEIN
Organism Severe acute respiratory syndrome coronavirus 2

Publication

A Systematic Survey of Reversibly Covalent Dipeptidyl Inhibitors of the SARS-CoV-2 Main Protease.
Geng ZZ, Atla S, Shaabani N, Vulupala V, Yang KS, Alugubelli YR, Khatua K, Chen PH, Xiao J, Blankenship LR, Ma XR, Vatansever EC, Cho CD, Ma Y, Allen R, Ji H, Xu S, Liu WR.
J Med Chem (2023) 66 : 11040 -11055
PubMed 37561993 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 3 7.17 7.52

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL3427166 1 7.52
CHEMBL478401 1 7.00
CHEMBL477164 1 6.99

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL3427166 IC50 = 30.0 nM 7.52
CHEMBL478401 IC50 = 100.0 nM 7.00
CHEMBL477164 IC50 = 103.0 nM 6.99