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Compile Data Set for Download or QSAR

Found 2 hits of ic50 for monomerid = 50099962   
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)
BDBM50099962
PNG
((3-Benzyl-3H-benzoimidazol-5-yl)-quinazolin-4-yl-a...)
Show SMILES C(c1ccccc1)n1cnc2ccc(Nc3ncnc4ccccc34)cc12
Show InChI InChI=1S/C22H17N5/c1-2-6-16(7-3-1)13-27-15-25-20-11-10-17(12-21(20)27)26-22-18-8-4-5-9-19(18)23-14-24-22/h1-12,14-15H,13H2,(H,23,24,26)
PDB
MMDB

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PC sid
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PubMed
n/an/a 4.40E+3n/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
Receptor tyrosine-protein kinase erbB-2


(Homo sapiens (Human))
BDBM50099962
PNG
((3-Benzyl-3H-benzoimidazol-5-yl)-quinazolin-4-yl-a...)
Show SMILES C(c1ccccc1)n1cnc2ccc(Nc3ncnc4ccccc34)cc12
Show InChI InChI=1S/C22H17N5/c1-2-6-16(7-3-1)13-27-15-25-20-11-10-17(12-21(20)27)26-22-18-8-4-5-9-19(18)23-14-24-22/h1-12,14-15H,13H2,(H,23,24,26)
PDB
MMDB

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

PubMed
n/an/a 2.10E+4n/an/an/an/an/an/a



Research Biomet. Glaxo Wellcome Medicines Research Centre

Curated by ChEMBL


Assay Description
Inhibition of c-erbB-2 overexpressing HB4a cell proliferation


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


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