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SMILES: COC(=O)NN=C(C)c1ccc2ccccc2c1OC(F)F

InChI Key: InChIKey=GFAICPIOKVFZEI-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 3 hits for monomerid = 74495   
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
Tyrosine-protein phosphatase non-receptor type 22


(Homo sapiens (Human))
BDBM74495
PNG
(MLS000391362 | N-[1-[1-(difluoromethoxy)-2-naphtha...)
Show SMILES COC(=O)NN=C(C)c1ccc2ccccc2c1OC(F)F |w:5.4|
Show InChI InChI=1S/C15H14F2N2O3/c1-9(18-19-15(20)21-2)11-8-7-10-5-3-4-6-12(10)13(11)22-14(16)17/h3-8,14H,1-2H3,(H,19,20)
PDB

UniProtKB/SwissProt

antibodypedia
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PC cid
PC sid
UniChem
PCBioAssay
n/an/a>7.94E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, ...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q24748BK
More data for this
Ligand-Target Pair
Tyrosine-protein phosphatase non-receptor type 22


(Homo sapiens (Human))
BDBM74495
PNG
(MLS000391362 | N-[1-[1-(difluoromethoxy)-2-naphtha...)
Show SMILES COC(=O)NN=C(C)c1ccc2ccccc2c1OC(F)F |w:5.4|
Show InChI InChI=1S/C15H14F2N2O3/c1-9(18-19-15(20)21-2)11-8-7-10-5-3-4-6-12(10)13(11)22-14(16)17/h3-8,14H,1-2H3,(H,19,20)
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem
PCBioAssay
n/an/a>7.94E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, ...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2CR5RTC
More data for this
Ligand-Target Pair
Tyrosine-protein phosphatase non-receptor type 7


(Homo sapiens (Human))
BDBM74495
PNG
(MLS000391362 | N-[1-[1-(difluoromethoxy)-2-naphtha...)
Show SMILES COC(=O)NN=C(C)c1ccc2ccccc2c1OC(F)F |w:5.4|
Show InChI InChI=1S/C15H14F2N2O3/c1-9(18-19-15(20)21-2)11-8-7-10-5-3-4-6-12(10)13(11)22-14(16)17/h3-8,14H,1-2H3,(H,19,20)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem
PCBioAssay
n/an/a>7.94E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2VQ314Z
More data for this
Ligand-Target Pair