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SMILES: Cn1nc(Nc2nc(nc3c2COC3(C)C)-c2cn[nH]c2)c2cccc(F)c12

InChI Key: InChIKey=FUHKGVKQAGCDHW-UHFFFAOYSA-N

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   Substructure
Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50142030   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kcal/mole		IC50
nM		Kd
nM		EC50/IC50
nM		koff
s-1		kon
M-1s-1		pHTemp
°C
Epidermal growth factor receptor/Receptor tyrosine-protein kinase erbB-2/Receptor tyrosine-protein kinase erbB-3/Receptor tyrosine-protein kinase erbB-4


(Homo sapiens (Human))		BDBM50142030
PNG
(CHEMBL3758830)
Show SMILES Cn1nc(Nc2nc(nc3c2COC3(C)C)-c2cn[nH]c2)c2cccc(F)c12
Show InChI InChI=1S/C19H18FN7O/c1-19(2)15-12(9-28-19)17(24-16(23-15)10-7-21-22-8-10)25-18-11-5-4-6-13(20)14(11)27(3)26-18/h4-8H,9H2,1-3H3,(H,21,22)(H,23,24,25,26)
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KEGG

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 57n/an/an/an/an/an/an/an/a



Genentech

Curated by ChEMBL


Assay Description
Inhibition of EGFR T790M/L858R mutant (unknown origin)

Bioorg Med Chem Lett 26: 534-9 (2016)


BindingDB Entry DOI: 10.7270/Q2HH6MZQ
More data for this
Ligand-Target Pair