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Assay Detail

CHEMBL4612347

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 incubated for 3 hrs by in-cell western method
26
Total Activities
25
Compounds Tested
2
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

Identification of the Clinical Development Candidate MRTX849, a Covalent KRASG12C Inhibitor for the Treatment of Cancer.
Fell JB, Fischer JP, Baer BR, Blake JF, Bouhana K, Briere DM, Brown KD, Burgess LE, Burns AC, Burkard MR, Chiang H, Chicarelli MJ, Cook AW, Gaudino JJ, Hallin J, Hanson L, Hartley DP, Hicken EJ, Hingorani GP, Hinklin RJ, Mejia MJ, Olson P, Otten JN, Rhodes SP, Rodriguez ME, Savechenkov P, Smith DJ, Sudhakar N, Sullivan FX, Tang TP, Vigers GP, Wollenberg L, Christensen JG, Marx MA.
J Med Chem (2020) 63 : 6679 -6693
PubMed 32250617 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 25 6.96 9.00
fIC50 1 - -

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL4648852 1 9.00
CHEMBL4632935 1 9.00
CHEMBL4640636 1 8.52
CHEMBL4636611 1 8.40
CHEMBL4646899 1 8.22
CHEMBL4645376 1 8.05
CHEMBL4648671 2 8.00
CHEMBL4594350 ADAGRASIB 4.0 1 7.85
CHEMBL4648056 1 7.85
CHEMBL4648124 1 7.66
CHEMBL4640234 1 7.19
CHEMBL4456598 1 6.85
CHEMBL4645768 1 6.59
CHEMBL4642659 1 6.46
CHEMBL4649703 1 5.99
CHEMBL4637314 1 5.97
CHEMBL4642347 1 5.93
CHEMBL4637434 1 5.82
CHEMBL4639210 1 5.48
CHEMBL4647242 1 5.36
CHEMBL4649174 1 5.34
CHEMBL4643600 1 5.33
CHEMBL4638484 1 5.32
CHEMBL4649393 1 -
CHEMBL4635454 1 -

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL4632935 IC50 = 1.0 nM 9.00
CHEMBL4648852 IC50 = 1.0 nM 9.00
CHEMBL4640636 IC50 = 3.0 nM 8.52
CHEMBL4636611 IC50 = 4.0 nM 8.40
CHEMBL4646899 IC50 = 6.0 nM 8.22
CHEMBL4645376 IC50 = 9.0 nM 8.05
CHEMBL4648671 IC50 = 10.0 nM 8.00
CHEMBL4594350 ADAGRASIB IC50 = 14.0 nM 7.85
CHEMBL4648056 IC50 = 14.0 nM 7.85
CHEMBL4648124 IC50 = 22.0 nM 7.66
CHEMBL4640234 IC50 = 64.0 nM 7.19
CHEMBL4456598 IC50 = 142.0 nM 6.85
CHEMBL4645768 IC50 = 254.0 nM 6.59
CHEMBL4642659 IC50 = 351.0 nM 6.46
CHEMBL4649703 IC50 = 1020.0 nM 5.99
CHEMBL4637314 IC50 = 1080.0 nM 5.97
CHEMBL4642347 IC50 = 1180.0 nM 5.93
CHEMBL4637434 IC50 = 1500.0 nM 5.82
CHEMBL4639210 IC50 = 3320.0 nM 5.48
CHEMBL4647242 IC50 = 4400.0 nM 5.36
CHEMBL4649174 IC50 = 4530.0 nM 5.34
CHEMBL4643600 IC50 = 4630.0 nM 5.33
CHEMBL4638484 IC50 = 4840.0 nM 5.32
CHEMBL4649393 IC50 > 5000.0 nM -
CHEMBL4635454 IC50 > 5000.0 nM -
CHEMBL4648671 fIC50 = 200.0 nM -