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BDBM50443983 CHEMBL3092299

SMILES: Fc1ccc(Nc2ncnc3cc(O[C@H]4CCOC4)c(NC(=O)N4CCCC(F)(F)C4)cc23)cc1Cl

InChI Key: InChIKey=CJVSLXNVNBNKOM-HNNXBMFYSA-N

Data: 1 IC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50443983   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Epidermal growth factor receptor


(Homo sapiens (Human))
BDBM50443983
PNG
(CHEMBL3092299)
Show SMILES Fc1ccc(Nc2ncnc3cc(O[C@H]4CCOC4)c(NC(=O)N4CCCC(F)(F)C4)cc23)cc1Cl |r|
Show InChI InChI=1S/C24H23ClF3N5O3/c25-17-8-14(2-3-18(17)26)31-22-16-9-20(32-23(34)33-6-1-5-24(27,28)12-33)21(10-19(16)29-13-30-22)36-15-4-7-35-11-15/h2-3,8-10,13,15H,1,4-7,11-12H2,(H,32,34)(H,29,30,31)/t15-/m0/s1
PDB
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KEGG

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DrugBank
antibodypedia
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PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 884n/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Inhibition of wild type EGFR (unknown origin) expressed in baculovirus expression system using poly (Glu, Tyr) 4:1 as substrate after 60 mins by ELIS...


Bioorg Med Chem 21: 7988-98 (2013)


Article DOI: 10.1016/j.bmc.2013.09.049
BindingDB Entry DOI: 10.7270/Q2ZK5J4G
More data for this
Ligand-Target Pair