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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 = 'BDBM50360134'   
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))
BDBM50360134
PNG
(CHEMBL1928956)
Show SMILES Fc1cccc(COc2ccc(Nc3cc(Oc4cccc(NC(=O)Cc5cc(F)c(F)cc5F)c4)ncn3)cc2Cl)c1
Show InChI InChI=1S/C31H21ClF4N4O3/c32-24-13-22(7-8-28(24)42-16-18-3-1-4-20(33)9-18)39-29-15-31(38-17-37-29)43-23-6-2-5-21(12-23)40-30(41)11-19-10-26(35)27(36)14-25(19)34/h1-10,12-15,17H,11,16H2,(H,40,41)(H,37,38,39)
PDB
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KEGG

UniProtKB/SwissProt

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PC cid
PC sid
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Similars

Article
PubMed
n/an/a 627n/an/an/an/an/an/a



East China University of Science and Technology

Curated by ChEMBL


Assay Description
Inhibition of human EGFR preincubated 2 hrs prior addition of ATP by HTRF assay


Bioorg Med Chem 20: 877-85 (2012)


Article DOI: 10.1016/j.bmc.2011.11.056
BindingDB Entry DOI: 10.7270/Q2N29XCQ
More data for this
Ligand-Target Pair