Reaction Details Report a problem with these data
Target
Epidermal growth factor receptor [695-745,751-1022,T790M,C797S]
Ligand
BDBM525543
Substrate
n/a
Meas. Tech.
Biochemical EGFR Inhibition Assays (5 mM ATP)
IC50
0.400±n/a nM
Citation
 Boese, D; Dahmann, G; Engelhardt, H; Petronczki, M; Scharn, D Benzimidazole compounds and derivatives as EGFR inhibitors US Patent  US11174245 Publication Date 11/16/2021 
Target
Name:
Epidermal growth factor receptor [695-745,751-1022,T790M,C797S]
Synonyms:
EGFR | EGFR (aa 895-745, aa 751-1022, T790M, C797S) | EGFR_HUMAN | ERBB | ERBB1 | HER1
Type:
Enzyme Catalytic Domain
Mol. Mass.:
36756.18
Organism:
Homo sapiens (Human)
Description:
P00533[695-745,751-1022,T790M,C797S]
Residue:
323
Sequence:
SGEAPNQALLRILKETEFKKIKVLGSGAFGTVYKGLWIPEGEKVKIPVAIKTSPKANKEILDEAYVMASVDNPHVCRLLGICLTSTVQLIMQLMPFGSLLDYVREHKDNIGSQYLLNWCVQIAKGMNYLEDRRLVHRDLAARNVLVKTPQHVKITDFGLAKLLGAEEKEYHAEGGKVPIKWMALESILHRIYTHQSDVWSYGVTVWELMTFGSKPYDGIPASEISSILEKGERLPQPPICTIDVYMIMVKCWMIDADSRPKFRELIIEFSKMARDPQRYLVIQGDERMHLPSPTDSNFYRALMDEEDMDDVVDADEYLIPQQG
  
Inhibitor
Name:
BDBM525543
Synonyms:
US11174245, # I-221
Type:
Small organic molecule
Emp. Form.:
C29H35N7O2
Mol. Mass.:
513.6339
SMILES:
Cc1cc(cc(n1)-c1cnn(C)c1)C(=O)\N=c1/[nH]c2ccc(CN3CCOCC3)cc2n1C1CCCCC1
Structure:
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