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Assay Detail

CHEMBL5512285

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

Binding
Inhibition of human HER2 YVMA mutant phosphorylation expressed in mouse NIH3T3 cells incubated for 1 hr by In-cell Western assay
34
Total Activities
34
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type Binding
Organism Homo sapiens
Cell Type NIH3T3
Confidence 0 — Uncurated / Unknown
Curated By Autocuration

Target

Unchecked (CHEMBL612545)
Type UNCHECKED

Publication

Discovery of Potent and Selective Covalent Inhibitors of HER2<sup>WT</sup> and HER2<sup>YVMA</sup>.
Hicken EJ, Brown K, Dwulet NC, Gaudino JJ, Hansen EP, Hartley DP, Kowalski JP, Laird ER, Lazzara NC, Li B, Mou TC, Mutryn MF, Oko L, Pajk S, Pipal RW, Rosen RZ, Shelp R, Singh A, Wang J, Wise CE, Wong C, Wong JY.
J Med Chem (2024) 67 : 9759 -9771
PubMed 38820338 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 34 6.50 7.54

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL5566478 1 7.54
CHEMBL5564323 1 7.51
CHEMBL1873475 IBRUTINIB 4.0 1 7.47
CHEMBL5561933 1 7.43
CHEMBL5555280 1 7.38
CHEMBL5549766 1 7.36
CHEMBL5549855 1 7.29
CHEMBL5561503 1 7.28
CHEMBL5542514 1 7.28
CHEMBL5542404 1 7.21
CHEMBL5557178 1 7.10
CHEMBL5559677 1 6.95
CHEMBL5557512 1 6.94
CHEMBL5558817 1 6.91
CHEMBL5559752 1 6.84
CHEMBL5559188 1 6.75
CHEMBL5523557 1 6.67
CHEMBL5561446 1 6.54
CHEMBL3989868 TUCATINIB 4.0 1 6.36
CHEMBL5567982 1 6.20
CHEMBL5527996 1 6.09
CHEMBL5531961 1 6.07
CHEMBL5556683 1 5.80
CHEMBL5555041 1 5.68
CHEMBL5518102 1 5.65
CHEMBL5563970 1 5.43
CHEMBL5559135 1 5.41
CHEMBL5563679 1 5.39
CHEMBL5523491 1 5.36
CHEMBL5527899 1 5.35

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL5566478 IC50 = 29.0 nM 7.54
CHEMBL5564323 IC50 = 31.0 nM 7.51
CHEMBL1873475 IBRUTINIB IC50 = 34.0 nM 7.47
CHEMBL5561933 IC50 = 37.0 nM 7.43
CHEMBL5555280 IC50 = 42.0 nM 7.38
CHEMBL5549766 IC50 = 44.0 nM 7.36
CHEMBL5549855 IC50 = 51.0 nM 7.29
CHEMBL5561503 IC50 = 52.0 nM 7.28
CHEMBL5542514 IC50 = 53.0 nM 7.28
CHEMBL5542404 IC50 = 61.0 nM 7.21
CHEMBL5557178 IC50 = 79.0 nM 7.10
CHEMBL5559677 IC50 = 112.0 nM 6.95
CHEMBL5557512 IC50 = 115.0 nM 6.94
CHEMBL5558817 IC50 = 124.0 nM 6.91
CHEMBL5559752 IC50 = 143.0 nM 6.84
CHEMBL5559188 IC50 = 176.0 nM 6.75
CHEMBL5523557 IC50 = 216.0 nM 6.67
CHEMBL5561446 IC50 = 292.0 nM 6.54
CHEMBL3989868 TUCATINIB IC50 = 438.0 nM 6.36
CHEMBL5567982 IC50 = 637.0 nM 6.20
CHEMBL5527996 IC50 = 818.0 nM 6.09
CHEMBL5531961 IC50 = 858.0 nM 6.07
CHEMBL5556683 IC50 = 1570.0 nM 5.80
CHEMBL5555041 IC50 = 2102.0 nM 5.68
CHEMBL5518102 IC50 = 2258.0 nM 5.65
CHEMBL5563970 IC50 = 3752.0 nM 5.43
CHEMBL5559135 IC50 = 3889.0 nM 5.41
CHEMBL5563679 IC50 = 4061.0 nM 5.39
CHEMBL5523491 IC50 = 4377.0 nM 5.36
CHEMBL5527899 IC50 = 4422.0 nM 5.35
CHEMBL5561464 IC50 = 4601.0 nM 5.34
CHEMBL5542937 IC50 = 4804.0 nM 5.32
CHEMBL5557058 IC50 > 5000.0 nM -
CHEMBL5557440 IC50 > 5000.0 nM -