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Assay Detail

CHEMBL4670944

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Binding
Inhibition of HER2-A775_G776insYVMA mutant (unknown origin) expressed in mouse BaF3 cells assessed as reduction in HER2 induced cell viability after 96 hrs by CellTiter-Glo assay
41
Total Activities
41
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type Binding
Organism Homo sapiens
Cell Type BaF3
Confidence 0 — Uncurated / Unknown
Curated By Autocuration

Target

Unchecked (CHEMBL612545)
Type UNCHECKED

Publication

Targeting Her2-insYVMA with Covalent Inhibitors-A Focused Compound Screening and Structure-Based Design Approach.
Lategahn J,Hardick J,Grabe T,Niggenaber J,Jeyakumar K,Keul M,Tumbrink HL,Becker C,Hodson L,Kirschner T,Klövekorn P,Ketzer J,Baumann M,Terheyden S,Unger A,Weisner J,Müller MP,van Otterlo WAL,Bauer S,Rauh D
J Med Chem (2020) 63 : 11725 -11755
PubMed 32931277 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 41 6.27 7.39

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL4760739 1 7.39
CHEMBL4778909 1 7.28
CHEMBL1173655 AFATINIB 4.0 1 7.24
CHEMBL4787483 1 7.08
CHEMBL4786257 1 7.08
CHEMBL4757145 1 6.92
CHEMBL4740834 1 6.87
CHEMBL4756368 1 6.80
CHEMBL4751089 1 6.59
CHEMBL4757450 1 6.54
CHEMBL4758224 1 6.52
CHEMBL4741898 1 6.49
CHEMBL4755170 1 6.46
CHEMBL4795165 1 6.42
CHEMBL4750655 1 6.41
CHEMBL4800516 1 6.39
CHEMBL4757592 1 6.37
CHEMBL4743066 1 6.30
CHEMBL4781593 1 6.25
CHEMBL4751894 1 6.21
CHEMBL4740009 1 6.20
CHEMBL4783667 1 6.17
CHEMBL4763834 1 6.12
CHEMBL4776708 1 6.04
CHEMBL4753389 1 5.95
CHEMBL3353410 OSIMERTINIB 4.0 1 5.86
CHEMBL4799276 1 5.84
CHEMBL4791900 1 5.65
CHEMBL4741020 1 5.62
CHEMBL4754658 1 5.57

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL4760739 IC50 = 41.0 nM 7.39
CHEMBL4778909 IC50 = 53.0 nM 7.28
CHEMBL1173655 AFATINIB IC50 = 58.0 nM 7.24
CHEMBL4787483 IC50 = 83.0 nM 7.08
CHEMBL4786257 IC50 = 84.0 nM 7.08
CHEMBL4757145 IC50 = 120.0 nM 6.92
CHEMBL4740834 IC50 = 135.0 nM 6.87
CHEMBL4756368 IC50 = 159.0 nM 6.80
CHEMBL4751089 IC50 = 259.0 nM 6.59
CHEMBL4757450 IC50 = 285.0 nM 6.54
CHEMBL4758224 IC50 = 304.0 nM 6.52
CHEMBL4741898 IC50 = 327.0 nM 6.49
CHEMBL4755170 IC50 = 349.0 nM 6.46
CHEMBL4795165 IC50 = 381.0 nM 6.42
CHEMBL4750655 IC50 = 390.0 nM 6.41
CHEMBL4800516 IC50 = 411.0 nM 6.39
CHEMBL4757592 IC50 = 431.0 nM 6.37
CHEMBL4743066 IC50 = 497.0 nM 6.30
CHEMBL4781593 IC50 = 562.0 nM 6.25
CHEMBL4751894 IC50 = 621.0 nM 6.21
CHEMBL4740009 IC50 = 638.0 nM 6.20
CHEMBL4783667 IC50 = 675.0 nM 6.17
CHEMBL4763834 IC50 = 754.0 nM 6.12
CHEMBL4776708 IC50 = 910.0 nM 6.04
CHEMBL4753389 IC50 = 1117.0 nM 5.95
CHEMBL3353410 OSIMERTINIB IC50 = 1389.0 nM 5.86
CHEMBL4799276 IC50 = 1445.0 nM 5.84
CHEMBL4791900 IC50 = 2216.0 nM 5.65
CHEMBL4741020 IC50 = 2416.0 nM 5.62
CHEMBL4754658 IC50 = 2683.0 nM 5.57
CHEMBL554 LAPATINIB IC50 = 2761.0 nM 5.56
CHEMBL4795863 IC50 = 2813.0 nM 5.55
CHEMBL939 GEFITINIB IC50 = 2882.0 nM 5.54
CHEMBL1614725 TAK-285 IC50 = 3218.0 nM 5.49
CHEMBL4785221 IC50 = 3302.0 nM 5.48
CHEMBL4759651 IC50 = 3602.0 nM 5.44
CHEMBL4759178 IC50 > 3000.0 nM -
CHEMBL4743509 IC50 > 3000.0 nM -
CHEMBL3545154 POZIOTINIB IC50 < 14.0 nM -
CHEMBL180022 NERATINIB IC50 < 14.0 nM -
CHEMBL4763660 IC50 > 3000.0 nM -