BDBM46250 (4E)-2-methoxy-4-[(pentan-3-ylamino)-sulfanyl-methylidene]cyclohexa-2,5-dien-1-one::(4E)-2-methoxy-4-[(pentan-3-ylamino)-sulfanylmethylidene]cyclohexa-2,5-dien-1-one::(4E)-4-[(1-ethylpropylamino)-mercapto-methylene]-2-methoxy-cyclohexa-2,5-dien-1-one::(4E)-4-[mercapto-(pentan-3-ylamino)methylidene]-2-methoxy-1-cyclohexa-2,5-dienone::MLS-0412118.0001::cid_44182131

SMILES CCC(CC)NC(=S)c1ccc(O)c(OC)c1

InChI Key InChIKey=YYNIOAPYKHRKHV-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 = 46250   

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

Curated by PubChem BioAssay
LigandPNGBDBM46250((4E)-2-methoxy-4-[(pentan-3-ylamino)-sulfanyl-meth...)
Affinity DataIC50:  8.12E+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 DepthDetails PCBioAssay
TargetDual specificity protein phosphatase 3(Homo sapiens (Human))
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM46250((4E)-2-methoxy-4-[(pentan-3-ylamino)-sulfanyl-meth...)
Affinity DataIC50:  1.83E+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 DepthDetails PCBioAssay
TargetDual specificity protein phosphatase 3(Homo sapiens (Human))
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM46250((4E)-2-methoxy-4-[(pentan-3-ylamino)-sulfanyl-meth...)
Affinity DataIC50:  1.71E+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 DepthDetails PCBioAssay
TargetTyrosine-protein phosphatase non-receptor type 7(Homo sapiens (Human))
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM46250((4E)-2-methoxy-4-[(pentan-3-ylamino)-sulfanyl-meth...)
Affinity DataIC50:  766nMAssay 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 DepthDetails PCBioAssay
TargetDual specificity protein phosphatase 3(Homo sapiens (Human))
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM46250((4E)-2-methoxy-4-[(pentan-3-ylamino)-sulfanyl-meth...)
Affinity DataIC50:  4.00E+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 DepthDetails PCBioAssay