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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 = 'BDBM50432374'   
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))
BDBM50432374
PNG
(CHEMBL2348418)
Show SMILES CS(=O)(=O)CCNC(=O)C1=Cc2c(Nc3ccc(Oc4cccc5sccc45)c(Cl)c3)ncnc2NCC1 |t:9|
Show InChI InChI=1S/C26H24ClN5O4S2/c1-38(34,35)12-10-29-26(33)16-7-9-28-24-19(13-16)25(31-15-30-24)32-17-5-6-22(20(27)14-17)36-21-3-2-4-23-18(21)8-11-37-23/h2-6,8,11,13-15H,7,9-10,12H2,1H3,(H,29,33)(H2,28,30,31,32)
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KEGG

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PC cid
PC sid
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Similars

Article
PubMed
n/an/a 47n/an/an/an/an/an/a



Takeda Pharmaceutical Co., Ltd

Curated by ChEMBL


Assay Description
Inhibition of human N-terminal DYKDDDD-tagged EGFR cytoplasmic domain (669 to 1210) expressed in baculovirus expression system incubated for 5 mins p...


Bioorg Med Chem 21: 2250-61 (2013)


Article DOI: 10.1016/j.bmc.2013.02.014
BindingDB Entry DOI: 10.7270/Q2TT4S9D
More data for this
Ligand-Target Pair