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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 = 'BDBM50499586'   
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))
BDBM50499586
PNG
(CHEMBL3741424)
Show SMILES COCCOc1cc2c(Nc3cccc(c3)C#C)ncnc2cc1OCCOC(=O)c1ccccc1OC(C)=O
Show InChI InChI=1S/C30H27N3O7/c1-4-21-8-7-9-22(16-21)33-29-24-17-27(37-13-12-36-3)28(18-25(24)31-19-32-29)38-14-15-39-30(35)23-10-5-6-11-26(23)40-20(2)34/h1,5-11,16-19H,12-15H2,2-3H3,(H,31,32,33)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 5n/an/an/an/an/an/a



Guangzhou Institutes of Biomedicine and Health

Curated by ChEMBL


Assay Description
Inhibition of EGFR (unknown origin) using tyrosine 4 as substrate by fluorescence analysis


ACS Med Chem Lett 6: 1086-90 (2015)


Article DOI: 10.1021/acsmedchemlett.5b00286
BindingDB Entry DOI: 10.7270/Q2ZG6W79
More data for this
Ligand-Target Pair