BDBM46204 (4Z)-2-methoxy-4-[(4-methylpiperidin-1-yl)-sulfanyl-methylidene]cyclohexa-2,5-dien-1-one::(4Z)-2-methoxy-4-[(4-methylpiperidin-1-yl)-sulfanylmethylidene]cyclohexa-2,5-dien-1-one::(4Z)-4-[mercapto-(4-methyl-1-piperidinyl)methylidene]-2-methoxy-1-cyclohexa-2,5-dienone::(4Z)-4-[mercapto-(4-methylpiperidino)methylene]-2-methoxy-cyclohexa-2,5-dien-1-one::MLS-0078446.0001::cid_5347726

SMILES COc1cc(ccc1O)C(=S)N1CCC(C)CC1

InChI Key InChIKey=IAROIMQWPVQUGD-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 = 46204   

TargetDual specificity protein phosphatase 3(Human)
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM46204(MLS-0078446.0001 | (4Z)-4-[mercapto-(4-methyl-1-pi...)
Affinity DataIC50: 1.21E+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
TargetTyrosine-protein phosphatase non-receptor type 7(Human)
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM46204(MLS-0078446.0001 | (4Z)-4-[mercapto-(4-methyl-1-pi...)
Affinity DataIC50: 1.61E+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:
6/5/2011
Entry Details
PCBioAssay
TargetDual specificity protein phosphatase 3(Human)
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM46204(MLS-0078446.0001 | (4Z)-4-[mercapto-(4-methyl-1-pi...)
Affinity DataIC50: 3.04E+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
LigandPNGBDBM46204(MLS-0078446.0001 | (4Z)-4-[mercapto-(4-methyl-1-pi...)
Affinity DataIC50: 1.00E+5nMAssay 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
LigandPNGBDBM46204(MLS-0078446.0001 | (4Z)-4-[mercapto-(4-methyl-1-pi...)
Affinity DataIC50: 1.00E+5nMAssay 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