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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 = 'BDBM50237054'   
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))		BDBM50237054
PNG
(CHEMBL4097454)
Show SMILES CCc1cccc(Nc2ncnc3ccc(NC(=S)NCc4ccccc4)cc23)c1
Show InChI InChI=1S/C24H23N5S/c1-2-17-9-6-10-19(13-17)28-23-21-14-20(11-12-22(21)26-16-27-23)29-24(30)25-15-18-7-4-3-5-8-18/h3-14,16H,2,15H2,1H3,(H2,25,29,30)(H,26,27,28)
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KEGG

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PC cid
PC sid
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Similars
Article
PubMed
n/an/a>150n/an/an/an/an/an/a



Saarland University

Curated by ChEMBL


Assay Description
Inhibition of human recombinant GST-tagged EGFR (668 to 1210 residues) cytoplasmic domain expressed in baculovirus expression system

J Med Chem 60: 2853-2868 (2017)


Article DOI: 10.1021/acs.jmedchem.6b01774
BindingDB Entry DOI: 10.7270/Q2K35WXP
More data for this
Ligand-Target Pair