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Assay Detail

CHEMBL4836595

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

Binding
Inhibition of MTase activity of N-terminal 6XHis-tagged SARS-CoV-2 NSP14 expressed in Escherichia coli BL21(DE3) using GpppG and SAM as substrate incubated for 20 mins by HTRF assay
12
Total Activities
12
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

Potent SARS-CoV-2 mRNA Cap Methyltransferase Inhibitors by Bioisosteric Replacement of Methionine in SAM Cosubstrate.
Bobiļeva O, Bobrovs R, Kaņepe I, Patetko L, Kalniņš G, Šišovs M, Bula AL, Gri Nberga S, Borodušķis MR, Ramata-Stunda A, Rostoks N, Jirgensons A, Ta Rs K, Jaudzems K.
ACS Med Chem Lett (2021) 12 : 1102 -1107
PubMed 34257831 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 12 6.12 8.10

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL4874278 1 8.10
CHEMBL4850353 1 6.80
CHEMBL4875728 1 6.52
CHEMBL1214186 SINEFUNGIN 2.0 1 6.35
CHEMBL4869943 1 6.18
CHEMBL4849284 1 6.16
CHEMBL4870702 1 5.19
CHEMBL4857500 1 4.92
CHEMBL4868791 1 4.90
CHEMBL4872017 1 -
CHEMBL4872937 1 -
CHEMBL4851408 1 -

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL4874278 IC50 = 8.0 nM 8.10
CHEMBL4850353 IC50 = 160.0 nM 6.80
CHEMBL4875728 IC50 = 300.0 nM 6.52
CHEMBL1214186 SINEFUNGIN IC50 = 450.0 nM 6.35
CHEMBL4869943 IC50 = 660.0 nM 6.18
CHEMBL4849284 IC50 = 690.0 nM 6.16
CHEMBL4870702 IC50 = 6480.0 nM 5.19
CHEMBL4857500 IC50 = 12000.0 nM 4.92
CHEMBL4868791 IC50 = 12500.0 nM 4.90
CHEMBL4872017 IC50 = 233000.0 nM -
CHEMBL4872937 IC50 - -
CHEMBL4851408 IC50 = 215000.0 nM -