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Compile Data Set for Download or QSAR

Found 4 hits Enz. Inhib. hit(s) with Target = 'Dual specificity protein phosphatase 1' and Ligand = 'BDBM35432'   
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 1


(Homo sapiens (Human))
BDBM35432
PNG
(3-[(3,4-dichlorobenzyl)amino]cyclopent-2-en-1-one ...)
Show SMILES Clc1ccc(CNC2=CC(=O)CC2)cc1Cl |t:7|
Show InChI InChI=1S/C12H11Cl2NO/c13-11-4-1-8(5-12(11)14)7-15-9-2-3-10(16)6-9/h1,4-6,15H,2-3,7H2
PDB
MMDB

NCI pathway
KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem
PCBioAssay
n/an/a>5.00E+4n/an/an/an/a7.022



University of Pittsburgh Molecular Library Screening Center

Curated by PubChem BioAssay


Assay Description
The MKP-1 HTS confirmation dose response assay has been developed to confirm actives identified in the MH-76391 In vitro HTS assay for MKP-1 inhibito...


PubChem Bioassay (2007)


BindingDB Entry DOI: 10.7270/Q2F769WQ
More data for this
Ligand-Target Pair
Dual specificity protein phosphatase 1


(Homo sapiens (Human))
BDBM35432
PNG
(3-[(3,4-dichlorobenzyl)amino]cyclopent-2-en-1-one ...)
Show SMILES Clc1ccc(CNC2=CC(=O)CC2)cc1Cl |t:7|
Show InChI InChI=1S/C12H11Cl2NO/c13-11-4-1-8(5-12(11)14)7-15-9-2-3-10(16)6-9/h1,4-6,15H,2-3,7H2
PDB
MMDB

NCI pathway
KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem
PCBioAssay
n/an/a>5.00E+4n/an/an/an/an/an/a



University of Pittsburgh Molecular Library Screening Center

Curated by PubChem BioAssay


Assay Description
The MKP-1 dose response assay Active/Probe Assessment Assay - Reproducibility testing has been developed to test the reproducibility of MKP-1 inhibit...


PubChem Bioassay (2006)


BindingDB Entry DOI: 10.7270/Q2QR4VH9
More data for this
Ligand-Target Pair
Dual specificity protein phosphatase 1


(Homo sapiens (Human))
BDBM35432
PNG
(3-[(3,4-dichlorobenzyl)amino]cyclopent-2-en-1-one ...)
Show SMILES Clc1ccc(CNC2=CC(=O)CC2)cc1Cl |t:7|
Show InChI InChI=1S/C12H11Cl2NO/c13-11-4-1-8(5-12(11)14)7-15-9-2-3-10(16)6-9/h1,4-6,15H,2-3,7H2
PDB
MMDB

NCI pathway
KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem
PCBioAssay
n/an/a>5.00E+4n/an/an/an/an/an/a



University of Pittsburgh Molecular Library Screening Center

Curated by PubChem BioAssay


Assay Description
The MKP-1 dose response Active/Probe assessment-Catalase assay has been developed to evaluate the effects of adding 100 U/mL of Catalase on the MKP-1...


PubChem Bioassay (2006)


BindingDB Entry DOI: 10.7270/Q2VH5M71
More data for this
Ligand-Target Pair
Dual specificity protein phosphatase 1


(Homo sapiens (Human))
BDBM35432
PNG
(3-[(3,4-dichlorobenzyl)amino]cyclopent-2-en-1-one ...)
Show SMILES Clc1ccc(CNC2=CC(=O)CC2)cc1Cl |t:7|
Show InChI InChI=1S/C12H11Cl2NO/c13-11-4-1-8(5-12(11)14)7-15-9-2-3-10(16)6-9/h1,4-6,15H,2-3,7H2
PDB
MMDB

NCI pathway
KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem
PCBioAssay
n/an/a>5.00E+4n/an/an/an/an/an/a



University of Pittsburgh Molecular Library Screening Center

Curated by PubChem BioAssay


Assay Description
The MKP-1 dose response Active/Probe assessment-DTT assay has been developed to evaluate the effects of increased DTT concentration on the MKP-1 inhi...


PubChem Bioassay (2006)


BindingDB Entry DOI: 10.7270/Q20863PV
More data for this
Ligand-Target Pair