BDBM46253 (4E)-4-[(cyclopentylamino)-mercapto-methylene]-2-methoxy-cyclohexa-2,5-dien-1-one::(4E)-4-[(cyclopentylamino)-mercaptomethylidene]-2-methoxy-1-cyclohexa-2,5-dienone::(4E)-4-[(cyclopentylamino)-sulfanyl-methylidene]-2-methoxy-cyclohexa-2,5-dien-1-one::(4E)-4-[(cyclopentylamino)-sulfanylmethylidene]-2-methoxycyclohexa-2,5-dien-1-one::MLS-0412122.0001::cid_44182134

SMILES COc1cc(ccc1O)C(=S)NC1CCCC1

InChI Key InChIKey=NKGYBBICVIDKFJ-UHFFFAOYSA-N

Data  5 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 5 hits for monomerid = 46253   

TargetTyrosine-protein phosphatase non-receptor type 7(Human)
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM46253((4E)-4-[(cyclopentylamino)-sulfanyl-methylidene]-2...)
Affinity DataIC50: 4.17E+3nMAssay Description:Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...More data for this Ligand-Target Pair
In Depth
Date in BDB:
5/28/2011
Entry Details
PCBioAssay
TargetDual specificity protein phosphatase 3(Human)
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM46253((4E)-4-[(cyclopentylamino)-sulfanyl-methylidene]-2...)
Affinity DataIC50: 6.61E+3nMAssay Description:Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...More data for this Ligand-Target Pair
In Depth
Date in BDB:
5/29/2011
Entry Details
PCBioAssay
TargetDual specificity protein phosphatase 3(Human)
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM46253((4E)-4-[(cyclopentylamino)-sulfanyl-methylidene]-2...)
Affinity DataIC50: 2.49E+4nMAssay Description:Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...More data for this Ligand-Target Pair
In Depth
Date in BDB:
5/29/2011
Entry Details
PCBioAssay
TargetTyrosine-protein phosphatase non-receptor type 7(Human)
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM46253((4E)-4-[(cyclopentylamino)-sulfanyl-methylidene]-2...)
Affinity DataIC50: 2.58E+3nMAssay Description:Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...More data for this Ligand-Target Pair
In Depth
Date in BDB:
6/5/2011
Entry Details
PCBioAssay
TargetDual specificity protein phosphatase 3(Human)
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM46253((4E)-4-[(cyclopentylamino)-sulfanyl-methylidene]-2...)
Affinity DataIC50: 1.39E+3nMAssay Description:Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...More data for this Ligand-Target Pair
In Depth
Date in BDB:
6/5/2011
Entry Details
PCBioAssay