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Found 1 hit Enz. Inhib. hit(s) with Target = 'Receptor tyrosine-protein kinase erbB-2' and Ligand = 'BDBM50391646'   
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
Receptor tyrosine-protein kinase erbB-2


(Homo sapiens (Human))		BDBM50391646
PNG
(CHEMBL2148046)
Show SMILES CC(C)S(=O)(=O)CC(=O)NCCn1ccc2ncnc(Nc3ccc(Oc4cccc(c4)C(F)(F)F)c(Cl)c3)c12
Show InChI InChI=1S/C26H25ClF3N5O4S/c1-16(2)40(37,38)14-23(36)31-9-11-35-10-8-21-24(35)25(33-15-32-21)34-18-6-7-22(20(27)13-18)39-19-5-3-4-17(12-19)26(28,29)30/h3-8,10,12-13,15-16H,9,11,14H2,1-2H3,(H,31,36)(H,32,33,34)
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Similars
Article
PubMed
n/an/a 11n/an/an/an/an/an/a



Takeda Pharmaceutical Co. Ltd

Curated by ChEMBL


Assay Description
Inhibition of human N-terminal DYKDDDD tagged HER2 cytoplasmic domain amino acid 676 to 1255 expressed in baculovirus after 5 mins by scintillation c...

Bioorg Med Chem 20: 6171-80 (2012)


Article DOI: 10.1016/j.bmc.2012.08.002
BindingDB Entry DOI: 10.7270/Q21R6RMZ
More data for this
Ligand-Target Pair