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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 = 'BDBM50505036'   
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))		BDBM50505036
PNG
(CHEMBL4540138)
Show SMILES [Br-].Cn1c(C[N+](C)(C)C\C=C\C(=O)Nc2ccc3ncnc(Nc4cccc(Br)c4)c3c2)ccc1[N+]([O-])=O
Show InChI InChI=1S/C26H26BrN7O3/c1-32-21(10-12-25(32)33(36)37)16-34(2,3)13-5-8-24(35)30-20-9-11-23-22(15-20)26(29-17-28-23)31-19-7-4-6-18(27)14-19/h4-12,14-15,17H,13,16H2,1-3H3,(H-,28,29,30,31,35)/p+1/b8-5+
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KEGG

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antibodypedia
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PC cid
PC sid
UniChem
Article
PubMed
n/an/a 0.220n/an/an/an/an/an/a



Taipei Medical University

Curated by ChEMBL


Assay Description
Inhibition of erbB1 (unknown origin) using FRET-capable peptide substrate by FRET assay

J Med Chem 62: 2851-2893 (2019)


Article DOI: 10.1021/acs.jmedchem.8b00147
BindingDB Entry DOI: 10.7270/Q2ZP49CC
More data for this
Ligand-Target Pair