BindingDB logo
myBDB logout
Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Epidermal growth factor receptor' and Ligand = 'BDBM50238181'   
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))
BDBM50238181
PNG
(CHEMBL4071368)
Show SMILES CSc1nc(c([nH]1)-c1ccnc(Nc2cc(NC(=O)C=C)cc(c2)N2CCN(C)CC2)c1)-c1ccc(F)cc1
Show InChI InChI=1S/C29H30FN7OS/c1-4-26(38)33-23-16-22(17-24(18-23)37-13-11-36(2)12-14-37)32-25-15-20(9-10-31-25)28-27(34-29(35-28)39-3)19-5-7-21(30)8-6-19/h4-10,15-18H,1,11-14H2,2-3H3,(H,31,32)(H,33,38)(H,34,35)
PDB
MMDB

KEGG

UniProtKB/SwissProt

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

Similars

Article
PubMed
n/an/a<1n/an/an/an/an/an/a



Eberhard Karls University T£bingen

Curated by ChEMBL


Assay Description
Inhibition of human N-terminal GST-fused EGFR cytoplasmic domain (669 to 1210 residues) expressed in baculovirus using TK-substrate-biotin preincubat...


J Med Chem 60: 5613-5637 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00316
BindingDB Entry DOI: 10.7270/Q2V98BCK
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))
BDBM50238181
PNG
(CHEMBL4071368)
Show SMILES CSc1nc(c([nH]1)-c1ccnc(Nc2cc(NC(=O)C=C)cc(c2)N2CCN(C)CC2)c1)-c1ccc(F)cc1
Show InChI InChI=1S/C29H30FN7OS/c1-4-26(38)33-23-16-22(17-24(18-23)37-13-11-36(2)12-14-37)32-25-15-20(9-10-31-25)28-27(34-29(35-28)39-3)19-5-7-21(30)8-6-19/h4-10,15-18H,1,11-14H2,2-3H3,(H,31,32)(H,33,38)(H,34,35)
PDB
MMDB

KEGG

UniProtKB/SwissProt

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

Similars

Article
PubMed
n/an/a 11n/an/an/an/an/an/a


TBA



Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c00876
BindingDB Entry DOI: 10.7270/Q2QF8XXX
More data for this
Ligand-Target Pair