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Assay Detail

CHEMBL4041201

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

Binding
Displacement of [3H]-cyclopamine from SMO V404M mutant in gefitinib resistant human HCC827 cells by scintillation counting
10
Total Activities
10
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 smoothened (CHEMBL5971)
Type SINGLE PROTEIN
Organism Homo sapiens

Publication

Dual MET and SMO Negative Modulators Overcome Resistance to EGFR Inhibitors in Human Nonsmall Cell Lung Cancer.
Morgillo F, Amendola G, Della Corte CM, Giacomelli C, Botta L, Di Maro S, Messere A, Ciaramella V, Taliani S, Marinelli L, Trincavelli ML, Martini C, Novellino E, Ciardiello F, Cosconati S.
J Med Chem (2017) 60 : 7447 -7458
PubMed 28787156 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
Ki 10 7.22 7.91

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL473417 VISMODEGIB 4.0 1 7.91
CHEMBL1852688 INFIGRATINIB 4.0 1 7.33
CHEMBL386051 1 7.33
CHEMBL4105444 1 7.30
CHEMBL254129 CYCLOPAMINE 1 7.29
CHEMBL254760 1 7.28
CHEMBL1230609 FORETINIB 2.0 1 7.17
CHEMBL223360 LINIFANIB 3.0 1 7.06
CHEMBL1796172 1 6.77
CHEMBL2029988 CEP-32496 2.0 1 6.73

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL473417 VISMODEGIB Ki = 12.2 nM 7.91
CHEMBL1852688 INFIGRATINIB Ki = 46.5 nM 7.33
CHEMBL386051 Ki = 46.2 nM 7.33
CHEMBL4105444 Ki = 50.4 nM 7.30
CHEMBL254129 CYCLOPAMINE Ki = 51.0 nM 7.29
CHEMBL254760 Ki = 53.1 nM 7.28
CHEMBL1230609 FORETINIB Ki = 66.8 nM 7.17
CHEMBL223360 LINIFANIB Ki = 87.6 nM 7.06
CHEMBL1796172 Ki = 168.1 nM 6.77
CHEMBL2029988 CEP-32496 Ki = 187.8 nM 6.73