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Compile Data Set for Download or QSAR

Found 3 hits Enz. Inhib. hit(s) with Target = 'Dual specificity protein phosphatase 3' and Ligand = 'BDBM46251'   
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
Dual specificity protein phosphatase 3


(Homo sapiens (Human))
BDBM46251
PNG
((4E)-4-[diethylamino(mercapto)methylene]-2-methoxy...)
Show SMILES CCN(CC)C(=S)c1ccc(O)c(OC)c1
Show InChI InChI=1S/C12H17NO2S/c1-4-13(5-2)12(16)9-6-7-10(14)11(8-9)15-3/h6-8,14H,4-5H2,1-3H3
PDB
MMDB

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KEGG

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PC cid
PC sid
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PCBioAssay
n/an/a 5.76E+3n/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 (2009)


BindingDB Entry DOI: 10.7270/Q2WW7G20
More data for this
Ligand-Target Pair
Dual specificity protein phosphatase 3


(Homo sapiens (Human))
BDBM46251
PNG
((4E)-4-[diethylamino(mercapto)methylene]-2-methoxy...)
Show SMILES CCN(CC)C(=S)c1ccc(O)c(OC)c1
Show InChI InChI=1S/C12H17NO2S/c1-4-13(5-2)12(16)9-6-7-10(14)11(8-9)15-3/h6-8,14H,4-5H2,1-3H3
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Patents


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PCBioAssay
n/an/a 2.64E+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 (2009)


BindingDB Entry DOI: 10.7270/Q2DB807Z
More data for this
Ligand-Target Pair
Dual specificity protein phosphatase 3


(Homo sapiens (Human))
BDBM46251
PNG
((4E)-4-[diethylamino(mercapto)methylene]-2-methoxy...)
Show SMILES CCN(CC)C(=S)c1ccc(O)c(OC)c1
Show InChI InChI=1S/C12H17NO2S/c1-4-13(5-2)12(16)9-6-7-10(14)11(8-9)15-3/h6-8,14H,4-5H2,1-3H3
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Patents


Similars

PCBioAssay
n/an/a>1.00E+5n/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 (2009)


BindingDB Entry DOI: 10.7270/Q28K77H7
More data for this
Ligand-Target Pair