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Assay Detail

CHEMBL5155034

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

Binding
Non-covalent inhibition of SARS-Cov -Mpro incubated for 30 mins using FRET substrate measured for 1 hr by FRET-based enzymatic assay
3
Total Activities
3
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type Binding
Organism Severe acute respiratory syndrome-related coronavirus
Confidence 0 — Uncurated / Unknown
Curated By Autocuration

Target

Unchecked (CHEMBL612545)
Type UNCHECKED

Publication

Expedited Approach toward the Rational Design of Noncovalent SARS-CoV-2 Main Protease Inhibitors.
Kitamura N, Sacco MD, Ma C, Hu Y, Townsend JA, Meng X, Zhang F, Zhang X, Ba M, Szeto T, Kukuljac A, Marty MT, Schultz D, Cherry S, Xiang Y, Chen Y, Wang J.
J Med Chem (2022) 65 : 2848 -2865
PubMed 33891389 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 3 6.33 7.46

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL3427166 1 7.46
CHEMBL5206501 1 6.57
CHEMBL2311694 1 4.95

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL3427166 IC50 = 35.0 nM 7.46
CHEMBL5206501 IC50 = 270.0 nM 6.57
CHEMBL2311694 IC50 = 11230.0 nM 4.95