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Assay Detail

CHEMBL1064922

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

Binding
Inhibition of HER2
26
Total Activities
26
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type Binding
Confidence 8 — Homologous single protein target
Curated By Autocuration

Target

Receptor tyrosine-protein kinase erbB-2 (CHEMBL1824)
Type SINGLE PROTEIN
Organism Homo sapiens

Publication

Discovery of 7-(4-(3-ethynylphenylamino)-7-methoxyquinazolin-6-yloxy)-N-hydroxyheptanamide (CUDc-101) as a potent multi-acting HDAC, EGFR, and HER2 inhibitor for the treatment of cancer.
Cai X, Zhai HX, Wang J, Forrester J, Qu H, Yin L, Lai CJ, Bao R, Qian C.
J Med Chem (2010) 53 : 2000 -2009
PubMed 20143778 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 26 7.36 8.00

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL598799 1 8.00
CHEMBL554 LAPATINIB 4.0 1 7.99
CHEMBL597551 1 7.97
CHEMBL597752 1 7.91
CHEMBL596736 1 7.82
CHEMBL598797 CUDC-101 1.0 1 7.80
CHEMBL598377 1 7.72
CHEMBL598163 1 7.70
CHEMBL597773 1 7.70
CHEMBL597569 1 7.62
CHEMBL596754 1 7.62
CHEMBL605976 1 7.56
CHEMBL599398 1 7.42
CHEMBL598164 1 7.42
CHEMBL604094 1 7.36
CHEMBL598611 1 7.29
CHEMBL598610 1 7.15
CHEMBL598798 1 7.12
CHEMBL553 ERLOTINIB 4.0 1 6.87
CHEMBL598406 1 6.76
CHEMBL596761 1 6.65
CHEMBL596964 1 6.53
CHEMBL596957 1 6.32
CHEMBL598407 1 6.25
CHEMBL596755 1 -
CHEMBL599218 1 -

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL598799 IC50 = 10.1 nM 8.00
CHEMBL554 LAPATINIB IC50 = 10.2 nM 7.99
CHEMBL597551 IC50 = 10.6 nM 7.97
CHEMBL597752 IC50 = 12.4 nM 7.91
CHEMBL596736 IC50 = 15.0 nM 7.82
CHEMBL598797 CUDC-101 IC50 = 15.7 nM 7.80
CHEMBL598377 IC50 = 19.0 nM 7.72
CHEMBL598163 IC50 = 20.0 nM 7.70
CHEMBL597773 IC50 = 20.1 nM 7.70
CHEMBL597569 IC50 = 24.0 nM 7.62
CHEMBL596754 IC50 = 24.2 nM 7.62
CHEMBL605976 IC50 = 27.8 nM 7.56
CHEMBL599398 IC50 = 38.4 nM 7.42
CHEMBL598164 IC50 = 38.2 nM 7.42
CHEMBL604094 IC50 = 43.5 nM 7.36
CHEMBL598611 IC50 = 51.6 nM 7.29
CHEMBL598610 IC50 = 71.2 nM 7.15
CHEMBL598798 IC50 = 76.5 nM 7.12
CHEMBL553 ERLOTINIB IC50 = 134.5 nM 6.87
CHEMBL598406 IC50 = 175.0 nM 6.76
CHEMBL596761 IC50 = 225.2 nM 6.65
CHEMBL596964 IC50 = 295.4 nM 6.53
CHEMBL596957 IC50 = 478.2 nM 6.32
CHEMBL598407 IC50 = 556.9 nM 6.25
CHEMBL596755 IC50 > 2000.0 nM -
CHEMBL599218 IC50 > 2000.0 nM -