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Assay Detail

CHEMBL934600

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Binding
Inhibition of iNOS
14
Total Activities
14
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type Binding
Confidence 8 — Homologous single protein target
Curated By Autocuration

Target

Nitric oxide synthase, inducible (CHEMBL4481)
Type SINGLE PROTEIN
Organism Homo sapiens

Publication

"Virtual fragment linking": an approach to identify potent binders from low affinity fragment hits.
Crisman TJ, Bender A, Milik M, Jenkins JL, Scheiber J, Sukuru SC, Fejzo J, Hommel U, Davies JW, Glick M.
J Med Chem (2008) 51 : 2481 -2491
PubMed 18357974 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 14 5.88 7.28

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL112866 1 7.28
CHEMBL170580 1 7.17
CHEMBL112246 1 7.05
CHEMBL170176 1 6.52
CHEMBL62077 1 5.96
CHEMBL409050 1 5.92
CHEMBL260277 1 5.92
CHEMBL85823 1 5.85
CHEMBL174481 1 5.60
CHEMBL360616 1 5.47
CHEMBL292099 1 5.24
CHEMBL355856 1 5.01
CHEMBL112247 1 4.89
CHEMBL354899 1 4.50

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL112866 IC50 = 53.0 nM 7.28
CHEMBL170580 IC50 = 67.0 nM 7.17
CHEMBL112246 IC50 = 89.0 nM 7.05
CHEMBL170176 IC50 = 300.0 nM 6.52
CHEMBL62077 IC50 = 1100.0 nM 5.96
CHEMBL409050 IC50 = 1200.0 nM 5.92
CHEMBL260277 IC50 = 1200.0 nM 5.92
CHEMBL85823 IC50 = 1400.0 nM 5.85
CHEMBL174481 IC50 = 2500.0 nM 5.60
CHEMBL360616 IC50 = 3400.0 nM 5.47
CHEMBL292099 IC50 = 5700.0 nM 5.24
CHEMBL355856 IC50 = 9800.0 nM 5.01
CHEMBL112247 IC50 = 13000.0 nM 4.89
CHEMBL354899 IC50 = 32000.0 nM 4.50