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Assay Detail

CHEMBL3868487

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

Binding
Inhibition of HCV genotype 1b NS3/4A protease assessed as substrate cleavage using Ac-C(Eu)DDMEEAbu(COO)ASK(QSY7)-amide as substrate incubated for 30 mins prior to substrate addition measured after 2.5 hrs by time-resolved fluorescence assay
10
Total Activities
10
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type Binding
Organism Hepatitis C virus subtype 1b
Confidence 0 — Uncurated / Unknown
Curated By Autocuration

Target

Unchecked (CHEMBL612545)
Type UNCHECKED

Publication

Design and Synthesis of P2-P4 Macrocycles Containing a Unique Spirocyclic Proline: A New Class of HCV NS3/4A Inhibitors.
Velázquez F, Chelliah M, Clasby M, Guo Z, Howe J, Miller R, Neelamkavil S, Shah U, Soriano A, Xia Y, Venkatraman S, Chackalamannil S, Davies IW.
ACS Med Chem Lett (2016) 7 : 1173 -1178
PubMed 27994759 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 10 10.74 11.00

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL2063090 GRAZOPREVIR ANHYDROUS 4.0 1 11.00
CHEMBL3785323 1 11.00
CHEMBL3928647 1 11.00
CHEMBL3924454 1 11.00
CHEMBL3943429 1 10.70
CHEMBL3915464 1 10.70
CHEMBL3956226 1 10.52
CHEMBL3962860 1 10.52
CHEMBL3893915 1 10.52
CHEMBL3952146 1 10.40

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL2063090 GRAZOPREVIR ANHYDROUS IC50 = 0.01 nM 11.00
CHEMBL3785323 IC50 = 0.01 nM 11.00
CHEMBL3928647 IC50 = 0.01 nM 11.00
CHEMBL3924454 IC50 = 0.01 nM 11.00
CHEMBL3943429 IC50 = 0.02 nM 10.70
CHEMBL3915464 IC50 = 0.02 nM 10.70
CHEMBL3956226 IC50 = 0.03 nM 10.52
CHEMBL3962860 IC50 = 0.03 nM 10.52
CHEMBL3893915 IC50 = 0.03 nM 10.52
CHEMBL3952146 IC50 = 0.04 nM 10.40