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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Epidermal growth factor receptor' and Ligand = 'BDBM50428420'   
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))
BDBM50428420
PNG
(CHEMBL2333991)
Show SMILES COc1cc2ncnc(Nc3cccc(c3)-c3ccccc3)c2cc1OC
Show InChI InChI=1S/C22H19N3O2/c1-26-20-12-18-19(13-21(20)27-2)23-14-24-22(18)25-17-10-6-9-16(11-17)15-7-4-3-5-8-15/h3-14H,1-2H3,(H,23,24,25)
PDB
MMDB

KEGG

UniProtKB/SwissProt

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

Similars

Article
PubMed
n/an/a 127n/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Inhibition of EGFR (unknown origin) using biotinylated-PTP1B (Tyr66) as substrate incubated for 5 mins prior to substrate addition measured after 1 h...


Eur J Med Chem 61: 84-94 (2013)


Article DOI: 10.1016/j.ejmech.2012.07.036
BindingDB Entry DOI: 10.7270/Q2X068CH
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))
BDBM50428420
PNG
(CHEMBL2333991)
Show SMILES COc1cc2ncnc(Nc3cccc(c3)-c3ccccc3)c2cc1OC
Show InChI InChI=1S/C22H19N3O2/c1-26-20-12-18-19(13-21(20)27-2)23-14-24-22(18)25-17-10-6-9-16(11-17)15-7-4-3-5-8-15/h3-14H,1-2H3,(H,23,24,25)
PDB
MMDB

KEGG

UniProtKB/SwissProt

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

Similars

Article
PubMed
n/an/a>1.00E+4n/an/an/an/an/an/a



Universit£ degli Studi di Padova

Curated by ChEMBL


Assay Description
Inhibition of EGFR (unknown origin) assessed as incorporation of [32P] gamma-ATP in to myelin basic protein after 30 mins by autoradiographic analysi...


J Med Chem 57: 4598-605 (2014)


Article DOI: 10.1021/jm500034j
BindingDB Entry DOI: 10.7270/Q2KH0PW0
More data for this
Ligand-Target Pair