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Assay Detail

CHEMBL5154220

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

Functional
Antiviral activity against SARS-CoV-2 infected in Vero E6 cells preincubated for 1 hr followed by methylcellulose addition and measured after 25 to 26 hrs by EliSpot reader based analysis
7
Total Activities
7
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type Functional
Organism Severe acute respiratory syndrome coronavirus 2
Cell Type Vero E6
Confidence 1 — Organism
Curated By Autocuration

Target

SARS-CoV-2 (CHEMBL4303835)
Type ORGANISM
Organism Severe acute respiratory syndrome coronavirus 2

Publication

Discovery and Crystallographic Studies of Nonpeptidic Piperazine Derivatives as Covalent SARS-CoV-2 Main Protease Inhibitors.
Gao S, Song L, Claff T, Woodson M, Sylvester K, Jing L, Weiße RH, Cheng Y, Sträter N, Schäkel L, Gütschow M, Ye B, Yang M, Zhang T, Kang D, Toth K, Tavis J, Tollefson AE, Müller CE, Zhan P, Liu X.
J Med Chem (2022) 65 : 16902 -16917
PubMed 36475694 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
EC50 7 5.88 6.42

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL4802135 NIRMATRELVIR 4.0 1 6.42
CHEMBL5174111 1 6.40
CHEMBL5193842 1 5.86
CHEMBL4065616 REMDESIVIR 4.0 1 5.64
CHEMBL5206532 1 5.58
CHEMBL5180502 1 5.37
CHEMBL5190212 1 -

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL4802135 NIRMATRELVIR EC50 = 380.0 nM 6.42
CHEMBL5174111 EC50 = 400.0 nM 6.40
CHEMBL5193842 EC50 = 1370.0 nM 5.86
CHEMBL4065616 REMDESIVIR EC50 = 2270.0 nM 5.64
CHEMBL5206532 EC50 = 2640.0 nM 5.58
CHEMBL5180502 EC50 = 4240.0 nM 5.37
CHEMBL5190212 EC50 = 183000.0 nM -