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SMILES: CN(Cc1ccccc1N(CCCCC(O)=O)S(C)(=O)=O)c1nc(Nc2ccc3NCCc3c2)ncc1C(F)(F)F

InChI Key: InChIKey=XHVOZHLINNPOHR-UHFFFAOYSA-N

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Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50207360   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Focal adhesion kinase 1


(Homo sapiens (Human))
BDBM50207360
PNG
(CHEMBL3927099)
Show SMILES CN(Cc1ccccc1N(CCCCC(O)=O)S(C)(=O)=O)c1nc(Nc2ccc3NCCc3c2)ncc1C(F)(F)F
Show InChI InChI=1S/C27H31F3N6O4S/c1-35(17-19-7-3-4-8-23(19)36(41(2,39)40)14-6-5-9-24(37)38)25-21(27(28,29)30)16-32-26(34-25)33-20-10-11-22-18(15-20)12-13-31-22/h3-4,7-8,10-11,15-16,31H,5-6,9,12-14,17H2,1-2H3,(H,37,38)(H,32,33,34)
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 177n/an/an/an/an/an/a



Gilead Sciences, Inc.

Curated by ChEMBL


Assay Description
Inhibition of NH2-terminal His6-tagged FAK kinase domain (410 to 689 residues) (unknown origin) expressed in baculovirus infected sf9 cells using p(G...


Bioorg Med Chem Lett 26: 5926-5930 (2016)


Article DOI: 10.1016/j.bmcl.2016.10.092
BindingDB Entry DOI: 10.7270/Q2ST7RTJ
More data for this
Ligand-Target Pair
Protein-tyrosine kinase 2-beta


(Homo sapiens (Human))
BDBM50207360
PNG
(CHEMBL3927099)
Show SMILES CN(Cc1ccccc1N(CCCCC(O)=O)S(C)(=O)=O)c1nc(Nc2ccc3NCCc3c2)ncc1C(F)(F)F
Show InChI InChI=1S/C27H31F3N6O4S/c1-35(17-19-7-3-4-8-23(19)36(41(2,39)40)14-6-5-9-24(37)38)25-21(27(28,29)30)16-32-26(34-25)33-20-10-11-22-18(15-20)12-13-31-22/h3-4,7-8,10-11,15-16,31H,5-6,9,12-14,17H2,1-2H3,(H,37,38)(H,32,33,34)
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 201n/an/an/an/an/an/a



Gilead Sciences, Inc.

Curated by ChEMBL


Assay Description
Inhibition of full length recombinant human N-terminal His6-tagged PYK2 expressed in baculovirus infected sf21 cells


Bioorg Med Chem Lett 26: 5926-5930 (2016)


Article DOI: 10.1016/j.bmcl.2016.10.092
BindingDB Entry DOI: 10.7270/Q2ST7RTJ
More data for this
Ligand-Target Pair