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Assay Detail

CHEMBL4433157

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

Binding
Inhibition of recombinant human 6His-tagged PAD3 expressed in Escherichia coli BL21-DE3 pLysS assessed as reduction in residual activity preincubated for 15 mins followed by addition of N-benzoylated arginine ethyl ester hydrochloride measured after 15 mins by colder assay
8
Total Activities
8
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type Binding
Organism Homo sapiens
Confidence 9 — Direct single protein target
Curated By Autocuration

Target

Protein-arginine deiminase type-3 (CHEMBL1909488)
Type SINGLE PROTEIN
Organism Homo sapiens

Publication

Cellular Activity of New Small Molecule Protein Arginine Deiminase 3 (PAD3) Inhibitors.
Jamali H, Khan HA, Tjin CC, Ellman JA.
ACS Med Chem Lett (2016) 7 : 847 -851
PubMed 27660689 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 8 4.96 5.27

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL4468883 1 5.27
CHEMBL4473416 1 5.25
CHEMBL4464539 1 5.24
CHEMBL4449566 1 5.14
CHEMBL4547728 1 4.97
CHEMBL4461562 1 4.92
CHEMBL4442207 1 4.72
CHEMBL4546087 1 4.19

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL4468883 IC50 = 5400.0 nM 5.27
CHEMBL4473416 IC50 = 5600.0 nM 5.25
CHEMBL4464539 IC50 = 5800.0 nM 5.24
CHEMBL4449566 IC50 = 7300.0 nM 5.14
CHEMBL4547728 IC50 = 10700.0 nM 4.97
CHEMBL4461562 IC50 = 12000.0 nM 4.92
CHEMBL4442207 IC50 = 19000.0 nM 4.72
CHEMBL4546087 IC50 = 65000.0 nM 4.19