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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 = 'BDBM50500088'   
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))
BDBM50500088
PNG
(CHEMBL3740144)
Show SMILES CN1CCN(Cc2ccc(NC(=O)Nc3ccc4ncnc(Nc5ccc(OCc6cccc(F)c6)c(Cl)c5)c4c3)cc2)CC1
Show InChI InChI=1S/C34H33ClFN7O2/c1-42-13-15-43(16-14-42)20-23-5-7-26(8-6-23)40-34(44)41-27-9-11-31-29(18-27)33(38-22-37-31)39-28-10-12-32(30(35)19-28)45-21-24-3-2-4-25(36)17-24/h2-12,17-19,22H,13-16,20-21H2,1H3,(H,37,38,39)(H2,40,41,44)
PDB
MMDB

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UniProtKB/SwissProt

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DrugBank
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PC cid
PC sid
UniChem
Article
PubMed
n/an/a>1.00E+3n/an/an/an/an/an/a



Xi'an Jiaotong University

Curated by ChEMBL


Assay Description
Inhibition of VEGFR-2 (unknown origin) assessed as ATP level by luminescence analysis


Bioorg Med Chem 24: 179-90 (2016)


Article DOI: 10.1016/j.bmc.2015.12.001
BindingDB Entry DOI: 10.7270/Q2SJ1PM0
More data for this
Ligand-Target Pair