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Assay Detail

CHEMBL4703099

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

Binding
Inhibition of recombinant human MPO incubated for 10 mins in presence of 240 mM NaCl and 10 uM H2O2 by aminophenyl fluorescein based assay
16
Total Activities
16
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

Myeloperoxidase (CHEMBL2439)
Type SINGLE PROTEIN
Organism Homo sapiens

Publication

Discovery and structure activity relationships of 7-benzyl triazolopyridines as stable, selective, and reversible inhibitors of myeloperoxidase.
Shaw SA,Vokits BP,Dilger AK,Viet A,Clark CG,Abell LM,Locke GA,Duke G,Kopcho LM,Dongre A,Gao J,Krishnakumar A,Jusuf S,Khan J,Spronk SA,Basso MD,Zhao L,Cantor GH,Onorato JM,Wexler RR,Duclos F,Kick EK
Bioorg Med Chem (2020) 28 : 115723 -115723
PubMed 33007547 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 16 6.94 7.80

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL4776850 1 7.80
CHEMBL4780886 1 7.77
CHEMBL4753981 1 7.60
CHEMBL4764237 1 7.54
CHEMBL4798810 1 7.50
CHEMBL4530093 1 7.30
CHEMBL4754467 1 7.24
CHEMBL333928 1 6.98
CHEMBL4762281 1 6.96
CHEMBL4742088 1 6.90
CHEMBL4788921 1 6.54
CHEMBL4742000 1 6.17
CHEMBL4760627 1 5.77
CHEMBL4787700 1 5.13
CHEMBL4740815 1 -
CHEMBL4793857 1 -

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL4776850 IC50 = 16.0 nM 7.80
CHEMBL4780886 IC50 = 17.0 nM 7.77
CHEMBL4753981 IC50 = 25.0 nM 7.60
CHEMBL4764237 IC50 = 29.0 nM 7.54
CHEMBL4798810 IC50 = 32.0 nM 7.50
CHEMBL4530093 IC50 = 50.0 nM 7.30
CHEMBL4754467 IC50 = 57.0 nM 7.24
CHEMBL333928 IC50 = 105.0 nM 6.98
CHEMBL4762281 IC50 = 110.0 nM 6.96
CHEMBL4742088 IC50 = 127.0 nM 6.90
CHEMBL4788921 IC50 = 286.0 nM 6.54
CHEMBL4742000 IC50 = 683.0 nM 6.17
CHEMBL4760627 IC50 = 1696.0 nM 5.77
CHEMBL4787700 IC50 = 7450.0 nM 5.13
CHEMBL4740815 IC50 > 40000.0 nM -
CHEMBL4793857 IC50 > 40000.0 nM -