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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Receptor tyrosine-protein kinase erbB-2' and Ligand = 'BDBM50099965'   
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


(Rattus norvegicus)
BDBM50099965
PNG
((1-Benzyl-1H-indazol-5-yl)-quinazolin-4-yl-amine |...)
Show SMILES C(c1ccccc1)n1ncc2cc(Nc3ncnc4ccccc34)ccc12
Show InChI InChI=1S/C22H17N5/c1-2-6-16(7-3-1)14-27-21-11-10-18(12-17(21)13-25-27)26-22-19-8-4-5-9-20(19)23-15-24-22/h1-13,15H,14H2,(H,23,24,26)
PDB
MMDB

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PubMed
n/an/a 10n/an/an/an/an/an/a



Research Biomet. Glaxo Wellcome Medicines Research Centre

Curated by ChEMBL


Assay Description
Inhibition of rat Receptor protein-tyrosine kinase erbB2


Bioorg Med Chem Lett 11: 1401-5 (2001)


BindingDB Entry DOI: 10.7270/Q2W37VKB
More data for this
Ligand-Target Pair