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Assay Detail

CHEMBL1827704

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

Binding
Inhibition of of Bodipy-labelled cyclopamine binding to Smo expressed in COS-1 cells in presence of 20% NHS after 4 to 6 hrs by FACS flow cytometric analysis
23
Total Activities
23
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type Binding
Cell Type COS-1
Confidence 8 — Homologous single protein target
Curated By Autocuration

Target

Protein smoothened (CHEMBL5971)
Type SINGLE PROTEIN
Organism Homo sapiens

Publication

Identification of a series of 4-[3-(quinolin-2-yl)-1,2,4-oxadiazol-5-yl]piperazinyl ureas as potent smoothened antagonist hedgehog pathway inhibitors.
Ontoria JM, Bufi LL, Torrisi C, Bresciani A, Giomini C, Rowley M, Serafini S, Bin H, Hao W, Steinkühler C, Jones P.
Bioorg Med Chem Lett (2011) 21 : 5274 -5282
PubMed 21803580 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 23 6.05 7.60

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL1823864 1 7.60
CHEMBL1823863 1 7.48
CHEMBL1822468 1 7.41
CHEMBL1823865 1 6.75
CHEMBL1823591 1 6.16
CHEMBL1823862 1 6.12
CHEMBL1823861 1 5.96
CHEMBL1823857 1 5.89
CHEMBL1823860 1 5.82
CHEMBL1823841 1 5.80
CHEMBL1823859 1 5.80
CHEMBL1823584 1 5.46
CHEMBL1823855 1 5.43
CHEMBL1823843 1 5.39
CHEMBL1823616 1 5.35
CHEMBL1823858 1 5.32
CHEMBL1823854 1 5.07
CHEMBL1823844 1 -
CHEMBL1823851 1 -
CHEMBL1823849 1 -
CHEMBL1823848 1 -
CHEMBL1823847 1 -
CHEMBL1823845 1 -

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL1823864 IC50 = 25.0 nM 7.60
CHEMBL1823863 IC50 = 33.0 nM 7.48
CHEMBL1822468 IC50 = 39.0 nM 7.41
CHEMBL1823865 IC50 = 180.0 nM 6.75
CHEMBL1823591 IC50 = 700.0 nM 6.16
CHEMBL1823862 IC50 = 760.0 nM 6.12
CHEMBL1823861 IC50 = 1100.0 nM 5.96
CHEMBL1823857 IC50 = 1300.0 nM 5.89
CHEMBL1823860 IC50 = 1500.0 nM 5.82
CHEMBL1823841 IC50 = 1600.0 nM 5.80
CHEMBL1823859 IC50 = 1600.0 nM 5.80
CHEMBL1823584 IC50 = 3500.0 nM 5.46
CHEMBL1823855 IC50 = 3700.0 nM 5.43
CHEMBL1823843 IC50 = 4100.0 nM 5.39
CHEMBL1823616 IC50 = 4500.0 nM 5.35
CHEMBL1823858 IC50 = 4800.0 nM 5.32
CHEMBL1823854 IC50 = 8600.0 nM 5.07
CHEMBL1823844 IC50 > 2500.0 nM -
CHEMBL1823851 IC50 > 2500.0 nM -
CHEMBL1823849 IC50 > 2500.0 nM -
CHEMBL1823848 IC50 > 2500.0 nM -
CHEMBL1823847 IC50 > 2500.0 nM -
CHEMBL1823845 IC50 > 2500.0 nM -