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Assay Detail

CHEMBL4687504

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

Binding
Inhibition of SARS-CoV2 3C-like protease expressed in Escherichia coli BL21 (DE3) cells using Mca-AVLQSGFR-K(Dnp)K as substrate by fluorescence method
7
Total Activities
7
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type Binding
Organism Severe acute respiratory syndrome coronavirus 2
Confidence 0 — Uncurated / Unknown
Curated By Autocuration

Target

Unchecked (CHEMBL612545)
Type UNCHECKED

Publication

COVID-19: Drug Targets and Potential Treatments.
Gil C,Ginex T,Maestro I,Nozal V,Barrado-Gil L,Cuesta-Geijo MÁ,Urquiza J,Ramírez D,Alonso C,Campillo NE,Martinez A
J Med Chem (2020) 63 : 12359 -12386
PubMed 32511912 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 7 5.40 6.17

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL51085 EBSELEN 3.0 1 6.17
CHEMBL3545157 TIDEGLUSIB 2.0 1 5.81
CHEMBL460499 CARMOFUR 2.0 1 5.74
CHEMBL284861 1 5.60
CHEMBL964 DISULFIRAM 4.0 1 5.03
CHEMBL9470 SHIKONIN 1 4.80
CHEMBL406050 PX-12 2.0 1 4.67

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL51085 EBSELEN IC50 = 670.0 nM 6.17
CHEMBL3545157 TIDEGLUSIB IC50 = 1550.0 nM 5.81
CHEMBL460499 CARMOFUR IC50 = 1820.0 nM 5.74
CHEMBL284861 IC50 = 2500.0 nM 5.60
CHEMBL964 DISULFIRAM IC50 = 9350.0 nM 5.03
CHEMBL9470 SHIKONIN IC50 = 15750.0 nM 4.80
CHEMBL406050 PX-12 IC50 = 21390.0 nM 4.67