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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Focal adhesion kinase 1 [410-689]' and Ligand = 'BDBM418634'   
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 [410-689]


(Homo sapiens (Human))
BDBM418634
PNG
(N-[5-({[2-anilino-5- (trifluoromethyl)pyrimidin-4-...)
Show SMILES CN(c1cc(C)ncc1CNc1nc(Nc2ccccc2)ncc1C(F)(F)F)S(C)(=O)=O
Show InChI InChI=1S/C20H21F3N6O2S/c1-13-9-17(29(2)32(3,30)31)14(10-24-13)11-25-18-16(20(21,22)23)12-26-19(28-18)27-15-7-5-4-6-8-15/h4-10,12H,11H2,1-3H3,(H2,25,26,27,28)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 0.590n/an/an/an/an/an/a



Bayer HealthCare Pharmaceuticals Corporation



Assay Description
The in vitro activity of the compounds of the compounds of the invention may be determined by the following procedure. More particularly, the followi...


J Med Chem 50: 984-1000 (2007)


BindingDB Entry DOI: 10.7270/Q2T72KQP
More data for this
Ligand-Target Pair