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Assay Detail

CHEMBL1034436

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

Binding
Binding affinity to WNV NS2B(K96A)-NS3 protease measured as change of 15N chemical shift of Ser137 by NMR spectroscopy
1
Total Activities
1
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type Binding
Organism West Nile virus
Confidence 9 — Direct single protein target
Curated By Autocuration

Target

Genome polyprotein (CHEMBL5419)
Type SINGLE PROTEIN
Organism West Nile virus

Publication

Flaviviral protease inhibitors identified by fragment-based library docking into a structure generated by molecular dynamics.
Ekonomiuk D, Su XC, Ozawa K, Bodenreider C, Lim SP, Otting G, Huang D, Caflisch A.
J Med Chem (2009) 52 : 4860 -4868
PubMed 19572550 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
Kd 1 4.05 4.05

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL177281 AMICARBALIDE 2.0 1 4.05

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL177281 AMICARBALIDE Kd = 90000.0 nM 4.05