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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Epidermal growth factor receptor' and Ligand = 'BDBM50210706'   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kJ/mole		IC50
nM		Kd
nM		EC50/IC50
nM		koff
s-1		kon
M-1s-1		pHTemp
°C
Epidermal growth factor receptor


(Homo sapiens (Human))		BDBM50210706
PNG
(CHEMBL3933568)
Show SMILES COc1cc2c(Nc3ccc(NC(=O)Nc4ccccc4C)cc3)ncnc2cc1OCCCN1CCN(C)CC1
Show InChI InChI=1S/C31H37N7O3/c1-22-7-4-5-8-26(22)36-31(39)35-24-11-9-23(10-12-24)34-30-25-19-28(40-3)29(20-27(25)32-21-33-30)41-18-6-13-38-16-14-37(2)15-17-38/h4-5,7-12,19-21H,6,13-18H2,1-3H3,(H,32,33,34)(H2,35,36,39)
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PC cid
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n/an/a 502n/an/an/an/an/an/a



China Pharmaceutical University

Curated by ChEMBL


Assay Description
Inhibition of N-terminal GST-tagged human EGFR cytoplasmic domain (669 to 1210 residues) expressed in baculovirus expression system preincubated for ...

Eur J Med Chem 125: 245-254 (2017)


Article DOI: 10.1016/j.ejmech.2016.09.039
BindingDB Entry DOI: 10.7270/Q2QJ7K9C
More data for this
Ligand-Target Pair