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Assay Detail

CHEMBL4329928

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

Binding
Inhibition of KRAS G12C mutant in human NCI-H358 cells assessed as reduction in ERK phosphorylation measured after 3 hrs by Western blot analysis
10
Total Activities
10
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type Binding
Organism Homo sapiens
Cell Type NCI-H358
Confidence 9 — Direct single protein target
Curated By Autocuration

Target

GTPase KRas (CHEMBL2189121)
Type SINGLE PROTEIN
Organism Homo sapiens

Publication

Discovery of Tetrahydropyridopyrimidines as Irreversible Covalent Inhibitors of KRAS-G12C with In Vivo Activity.
Fell JB, Fischer JP, Baer BR, Ballard J, Blake JF, Bouhana K, Brandhuber BJ, Briere DM, Burgess LE, Burkard MR, Chiang H, Chicarelli MJ, Davidson K, Gaudino JJ, Hallin J, Hanson L, Hee K, Hicken EJ, Hinklin RJ, Marx MA, Mejia MJ, Olson P, Savechenkov P, Sudhakar N, Tang TP, Vigers GP, Zecca H, Christensen JG.
ACS Med Chem Lett (2018) 9 : 1230 -1234
PubMed 30613331 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 10 6.02 7.16

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL4456598 1 7.16
CHEMBL4465028 1 6.27
CHEMBL4525173 1 5.82
CHEMBL4550990 1 5.72
CHEMBL4457300 1 5.12
CHEMBL4466927 1 -
CHEMBL4549643 1 -
CHEMBL4453071 1 -
CHEMBL4453012 1 -
CHEMBL4540074 1 -

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL4456598 IC50 = 70.0 nM 7.16
CHEMBL4465028 IC50 = 540.0 nM 6.27
CHEMBL4525173 IC50 = 1500.0 nM 5.82
CHEMBL4550990 IC50 = 1900.0 nM 5.72
CHEMBL4457300 IC50 = 7600.0 nM 5.12
CHEMBL4466927 IC50 > 16000.0 nM -
CHEMBL4549643 IC50 > 16000.0 nM -
CHEMBL4453071 IC50 > 16000.0 nM -
CHEMBL4453012 IC50 > 16000.0 nM -
CHEMBL4540074 IC50 > 16000.0 nM -