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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 = 'BDBM50171523'   
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))
BDBM50171523
PNG
((4,5-Dichloro-2-fluoro-phenyl)-(6,7-dimethoxy-quin...)
Show SMILES COc1cc2ncnc(Nc3cc(Cl)c(Cl)cc3F)c2cc1OC
Show InChI InChI=1S/C16H12Cl2FN3O2/c1-23-14-3-8-12(6-15(14)24-2)20-7-21-16(8)22-13-5-10(18)9(17)4-11(13)19/h3-7H,1-2H3,(H,20,21,22)
PDB
MMDB

KEGG

UniProtKB/SwissProt

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

Patents


Similars

Article
PubMed
n/an/a 0.210n/an/an/an/an/an/a



Hadassah Hebrew University

Curated by ChEMBL


Assay Description
Inhibition of EGF Receptor autophosphorylation in A431 cell lysate


J Med Chem 48: 5337-48 (2005)


Article DOI: 10.1021/jm0580196
BindingDB Entry DOI: 10.7270/Q28S4PG3
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))
BDBM50171523
PNG
((4,5-Dichloro-2-fluoro-phenyl)-(6,7-dimethoxy-quin...)
Show SMILES COc1cc2ncnc(Nc3cc(Cl)c(Cl)cc3F)c2cc1OC
Show InChI InChI=1S/C16H12Cl2FN3O2/c1-23-14-3-8-12(6-15(14)24-2)20-7-21-16(8)22-13-5-10(18)9(17)4-11(13)19/h3-7H,1-2H3,(H,20,21,22)
PDB
MMDB

KEGG

UniProtKB/SwissProt

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

Patents


Similars

Article
PubMed
n/an/a 5n/an/an/an/an/an/a



Hadassah Hebrew University

Curated by ChEMBL


Assay Description
Inhibition of EGF Receptor autophosphorylation in A431 cell lysate; Range = 3-5 nM


J Med Chem 48: 5337-48 (2005)


Article DOI: 10.1021/jm0580196
BindingDB Entry DOI: 10.7270/Q28S4PG3
More data for this
Ligand-Target Pair