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SMILES: CC1(C)OCc2c1nc(nc2Nc1n[nH]c2ccccc12)-c1c[nH]nn1

InChI Key: InChIKey=APEHBMOICBLOJP-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 = 50142035   
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))		BDBM50142035
PNG
(CHEMBL3759696)
Show SMILES CC1(C)OCc2c1nc(nc2Nc1n[nH]c2ccccc12)-c1c[nH]nn1
Show InChI InChI=1S/C17H16N8O/c1-17(2)13-10(8-26-17)14(21-16(19-13)12-7-18-25-23-12)20-15-9-5-3-4-6-11(9)22-24-15/h3-7H,8H2,1-2H3,(H,18,23,25)(H2,19,20,21,22,24)
PDB

KEGG

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PC cid
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PubMed
 732n/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