BindingDB logo
myBDB logout

null

SMILES: CSc1nc(c([nH]1)-c1ccnc(Nc2cccc(NC(=O)C=C)c2)c1)-c1ccc(F)cc1

InChI Key: InChIKey=OQRDDTNIACNBCQ-UHFFFAOYSA-N

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50238160   
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))		BDBM50238160
PNG
(CHEMBL4087268)
Show SMILES CSc1nc(c([nH]1)-c1ccnc(Nc2cccc(NC(=O)C=C)c2)c1)-c1ccc(F)cc1
Show InChI InChI=1S/C24H20FN5OS/c1-3-21(31)28-19-6-4-5-18(14-19)27-20-13-16(11-12-26-20)23-22(29-24(30-23)32-2)15-7-9-17(25)10-8-15/h3-14H,1H2,2H3,(H,26,27)(H,28,31)(H,29,30)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars
Article
PubMed
n/an/a<1n/an/an/an/an/an/a



Eberhard Karls University T£bingen

Curated by ChEMBL


Assay Description
Inhibition of human N-terminal GST-fused EGFR cytoplasmic domain (669 to 1210 residues) expressed in baculovirus using TK-substrate-biotin preincubat...

J Med Chem 60: 5613-5637 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00316
BindingDB Entry DOI: 10.7270/Q2V98BCK
More data for this
Ligand-Target Pair