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SMILES: FC(F)(F)c1cnc2Sc3ccccc3Nc2c1

InChI Key: InChIKey=JDKUGFSKOBHFMC-UHFFFAOYSA-N

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 40962   
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
Protein-tyrosine kinase 2-beta


(Homo sapiens (Human))
BDBM40962
PNG
(3-(trifluoromethyl)-5H-pyrido[2,3-b][1,4]benzothia...)
Show SMILES FC(F)(F)c1cnc2Sc3ccccc3Nc2c1
Show InChI InChI=1S/C12H7F3N2S/c13-12(14,15)7-5-9-11(16-6-7)18-10-4-2-1-3-8(10)17-9/h1-6,17H
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
PCBioAssay
n/an/a>6.95E+4n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Affiliation: The Scripps Research Institute, TSRI Assa...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q2H993M3
More data for this
Ligand-Target Pair
Focal adhesion kinase 1


(Homo sapiens (Human))
BDBM40962
PNG
(3-(trifluoromethyl)-5H-pyrido[2,3-b][1,4]benzothia...)
Show SMILES FC(F)(F)c1cnc2Sc3ccccc3Nc2c1
Show InChI InChI=1S/C12H7F3N2S/c13-12(14,15)7-5-9-11(16-6-7)18-10-4-2-1-3-8(10)17-9/h1-6,17H
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
PCBioAssay
n/an/a 3.87E+3n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLSCN Center Name): The Scripps Research Institute Molecular Screening Center Center Affiliation: The Scripps Research Institute, TSRI Assa...


PubChem Bioassay (2007)


BindingDB Entry DOI: 10.7270/Q2GX48ZN
More data for this
Ligand-Target Pair