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Assay Detail

CHEMBL4388217

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

Binding
Inhibition of smo-mediated hedgehog signaling pathway in mouse ASZ001 cells assessed as decrease in Gli1 mRNA expression after 48 hrs by qPCR method
31
Total Activities
31
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type Binding
Organism Mus musculus
Confidence 9 — Direct single protein target
Curated By Autocuration

Target

Protein smoothened (CHEMBL6080)
Type SINGLE PROTEIN
Organism Mus musculus

Publication

Structure-Activity Relationships for Itraconazole-Based Triazolone Analogues as Hedgehog Pathway Inhibitors.
Pace JR, Teske KA, Chau LQ, Dash RC, Zaino AM, Wechsler-Reya RJ, Hadden MK.
J Med Chem (2019) 62 : 3873 -3885
PubMed 30896941 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 31 6.39 8.05

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL4472296 1 8.05
CHEMBL4450586 1 7.05
CHEMBL4440172 1 6.96
CHEMBL4562342 1 6.85
CHEMBL4572598 1 6.80
CHEMBL4472335 1 6.72
CHEMBL4447164 1 6.72
CHEMBL4473575 1 6.68
CHEMBL4562519 1 6.58
CHEMBL4462158 1 6.51
CHEMBL4583477 1 6.41
CHEMBL4471156 1 6.04
CHEMBL4455409 1 5.66
CHEMBL4543531 1 5.52
CHEMBL4473720 1 5.41
CHEMBL4571341 1 5.37
CHEMBL4456292 1 5.24
CHEMBL4553424 1 -
CHEMBL4556073 1 -
CHEMBL4530520 1 -
CHEMBL4565311 1 -
CHEMBL4464304 1 -
CHEMBL4561378 1 -
CHEMBL4541851 1 -
CHEMBL4466705 1 -
CHEMBL4538569 1 -
CHEMBL4447193 1 -
CHEMBL4448878 1 -
CHEMBL4438128 1 -
CHEMBL4551142 1 -

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL4472296 IC50 = 9.0 nM 8.05
CHEMBL4450586 IC50 = 89.0 nM 7.05
CHEMBL4440172 IC50 = 110.0 nM 6.96
CHEMBL4562342 IC50 = 140.0 nM 6.85
CHEMBL4572598 IC50 = 160.0 nM 6.80
CHEMBL4472335 IC50 = 190.0 nM 6.72
CHEMBL4447164 IC50 = 190.0 nM 6.72
CHEMBL4473575 IC50 = 210.0 nM 6.68
CHEMBL4562519 IC50 = 260.0 nM 6.58
CHEMBL4462158 IC50 = 310.0 nM 6.51
CHEMBL4583477 IC50 = 390.0 nM 6.41
CHEMBL4471156 IC50 = 920.0 nM 6.04
CHEMBL4455409 IC50 = 2200.0 nM 5.66
CHEMBL4543531 IC50 = 3000.0 nM 5.52
CHEMBL4473720 IC50 = 3900.0 nM 5.41
CHEMBL4571341 IC50 = 4300.0 nM 5.37
CHEMBL4456292 IC50 = 5700.0 nM 5.24
CHEMBL4553424 IC50 > 10000.0 nM -
CHEMBL4556073 IC50 > 10000.0 nM -
CHEMBL4530520 IC50 > 10000.0 nM -
CHEMBL4565311 IC50 > 10000.0 nM -
CHEMBL4464304 IC50 > 10000.0 nM -
CHEMBL4561378 IC50 > 10000.0 nM -
CHEMBL4541851 IC50 > 10000.0 nM -
CHEMBL4466705 IC50 > 10000.0 nM -
CHEMBL4538569 IC50 > 10000.0 nM -
CHEMBL4447193 IC50 > 10000.0 nM -
CHEMBL4448878 IC50 > 10000.0 nM -
CHEMBL4438128 IC50 > 10000.0 nM -
CHEMBL4551142 IC50 > 10000.0 nM -
CHEMBL4561019 IC50 > 10000.0 nM -