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SMILES: COc1cc(ccc1Nc1ncc2c(C)cc(=O)n(-c3cc(NC(=O)C=C)cc(c3)C(F)(F)F)c2n1)N1CCN(C)CC1

InChI Key: InChIKey=SBQNECOKZYOWMS-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50234193   
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


(Homo sapiens (Human))		BDBM50234193
PNG
(CHEMBL4068047)
Show SMILES COc1cc(ccc1Nc1ncc2c(C)cc(=O)n(-c3cc(NC(=O)C=C)cc(c3)C(F)(F)F)c2n1)N1CCN(C)CC1
Show InChI InChI=1S/C30H30F3N7O3/c1-5-26(41)35-20-13-19(30(31,32)33)14-22(15-20)40-27(42)12-18(2)23-17-34-29(37-28(23)40)36-24-7-6-21(16-25(24)43-4)39-10-8-38(3)9-11-39/h5-7,12-17H,1,8-11H2,2-4H3,(H,35,41)(H,34,36,37)
PDB
MMDB

KEGG

UniProtKB/SwissProt

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PC cid
PC sid
UniChem

Similars
PubMed
n/an/a 182n/an/an/an/an/an/a



Guangzhou Institutes of Biomedicine and Health

Curated by ChEMBL


Assay Description
Inhibition of N-terminal 6His/TEV protease cleavage site-tagged wild type human EGFR using poly (Glu,Tyr) 4:1 as substrate after 1 hr by ELISA

Eur J Med Chem 126: 1107-1117 (2017)


BindingDB Entry DOI: 10.7270/Q2F47RD5
More data for this
Ligand-Target Pair