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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Focal adhesion kinase 1' and Ligand = 'BDBM50236992'   
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
Focal adhesion kinase 1


(Homo sapiens (Human))
BDBM50236992
PNG
(CHEMBL4098626)
Show SMILES CNC(=O)c1ccccc1Nc1nc(Nc2ccc(CN)cc2)nnc1Cl
Show InChI InChI=1S/C18H18ClN7O/c1-21-17(27)13-4-2-3-5-14(13)23-16-15(19)25-26-18(24-16)22-12-8-6-11(10-20)7-9-12/h2-9H,10,20H2,1H3,(H,21,27)(H2,22,23,24,26)
PDB
MMDB

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Article
PubMed
n/an/a 560n/an/an/an/an/an/a



Universit£ Paris Descartes

Curated by ChEMBL


Assay Description
Inhibition of FAK (unknown origin) using Ulight-poly(Glu:Tyr)(4:1) as substrate after 1.6 hrs by TR-FRET assay


Bioorg Med Chem Lett 27: 1727-1730 (2017)


Article DOI: 10.1016/j.bmcl.2017.02.072
BindingDB Entry DOI: 10.7270/Q2ZC855F
More data for this
Ligand-Target Pair