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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Vascular endothelial growth factor receptor 2' and Ligand = 'BDBM50498452'   
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))
BDBM50498452
PNG
(CHEMBL3596873)
Show SMILES CC(C)(C)c1cc(NC(=O)Nc2cccc(Oc3cncc(n3)-c3ccc(cc3)S(C)(=O)=O)c2)no1
Show InChI InChI=1S/C25H25N5O5S/c1-25(2,3)21-13-22(30-35-21)29-24(31)27-17-6-5-7-18(12-17)34-23-15-26-14-20(28-23)16-8-10-19(11-9-16)36(4,32)33/h5-15H,1-4H3,(H2,27,29,30,31)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 4.80E+3n/an/an/an/an/an/a



The University of Arizona

Curated by ChEMBL


Assay Description
Inhibition of KDR (unknown origin) using ATP and 5FAM tagged TrkA peptide substrate incubated for 60 mins by microfluidics assay


Medchemcomm 5: 1507-1514 (2014)


Article DOI: 10.1039/c4md00251b
BindingDB Entry DOI: 10.7270/Q2WW7MQ5
More data for this
Ligand-Target Pair