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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Vascular endothelial growth factor receptor 2' and Ligand = 'BDBM50308199'   
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
Vascular endothelial growth factor receptor 2


(Homo sapiens (Human))
BDBM50308199
PNG
(2-(4-Ethoxyanilino)-5,7-dihydro-6H-pyrido[4,3-b]py...)
Show SMILES CCOc1ccc(Nc2ncc3CC(=O)Nc4ccncc4-c3n2)cc1
Show InChI InChI=1S/C19H17N5O2/c1-2-26-14-5-3-13(4-6-14)22-19-21-10-12-9-17(25)23-16-7-8-20-11-15(16)18(12)24-19/h3-8,10-11H,2,9H2,1H3,(H,23,25)(H,21,22,24)
PDB
MMDB

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PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 99n/an/an/an/an/an/a



Technische Universitat Braunschweig

Curated by ChEMBL


Assay Description
Inhibition of VEGFR2 assessed as [33Pi] incorporation by microplate scintillation counting in presence of 1 uM ATP


J Med Chem 53: 2433-42 (2010)


Article DOI: 10.1021/jm901388c
BindingDB Entry DOI: 10.7270/Q24J0G22
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2


(Homo sapiens (Human))
BDBM50308199
PNG
(2-(4-Ethoxyanilino)-5,7-dihydro-6H-pyrido[4,3-b]py...)
Show SMILES CCOc1ccc(Nc2ncc3CC(=O)Nc4ccncc4-c3n2)cc1
Show InChI InChI=1S/C19H17N5O2/c1-2-26-14-5-3-13(4-6-14)22-19-21-10-12-9-17(25)23-16-7-8-20-11-15(16)18(12)24-19/h3-8,10-11H,2,9H2,1H3,(H,23,25)(H,21,22,24)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

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

Similars

Article
PubMed
n/an/a 1.86E+4n/an/an/an/an/an/a



Technische Universitat Braunschweig

Curated by ChEMBL


Assay Description
Inhibition of VEGFR2 in HUE cells assessed as inhibition of VEGF-induced autophosphorylation treated for 90 mins before VEGF challenge by ELISA


J Med Chem 53: 2433-42 (2010)


Article DOI: 10.1021/jm901388c
BindingDB Entry DOI: 10.7270/Q24J0G22
More data for this
Ligand-Target Pair