BDBM64546 4-ethyl-3-(2-methyl-5-thiophen-2-yl-thieno[2,3-d]pyrimidin-4-yl)sulfanyl-1H-1,2,4-triazol-5-one::4-ethyl-3-(2-methyl-5-thiophen-2-ylthieno[2,3-d]pyrimidin-4-yl)sulfanyl-1H-1,2,4-triazol-5-one::4-ethyl-3-[(2-methyl-5-thiophen-2-yl-4-thieno[2,3-d]pyrimidinyl)thio]-1H-1,2,4-triazol-5-one::4-ethyl-3-[[2-methyl-5-(2-thienyl)thieno[2,3-d]pyrimidin-4-yl]thio]-1H-1,2,4-triazol-5-one::MLS000056329::SMR000068446::cid_2559955

SMILES CCn1c(Sc2nc(C)nc3scc(-c4cccs4)c23)n[nH]c1=O

InChI Key InChIKey=KDEMIOZWVOAGJT-UHFFFAOYSA-N

Data  4 EC50

  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 4 hits for monomerid = 64546   

TargetATP-dependent molecular chaperone HSP82(Yeast)
Broad Institute

Curated by PubChem BioAssay
LigandPNGBDBM64546(4-ethyl-3-(2-methyl-5-thiophen-2-yl-thieno[2,3-d]p...)
Affinity DataEC50: >1.60E+5nMAssay Description:Keywords: Candida albicans, drug resistance, Fluconazole, Hsp90, Calcineurin, stress response Primary Collaborators: Susan Lindquist, Whitehead Insti...More data for this Ligand-Target Pair
In Depth
Date in BDB:
7/10/2011
Entry Details
PCBioAssay
TargetSerine/threonine-protein phosphatase(Yeast)
Broad Institute

Curated by PubChem BioAssay
LigandPNGBDBM64546(4-ethyl-3-(2-methyl-5-thiophen-2-yl-thieno[2,3-d]p...)
Affinity DataEC50:  1.80E+5nMAssay Description:Keywords: Candida albicans, drug resistance, Fluconazole, calcineurin, stress response Assay Overview: Method for determining if compound acts as Ca...More data for this Ligand-Target Pair
In Depth
Date in BDB:
7/10/2011
Entry Details
PCBioAssay
TargetATP-dependent molecular chaperone HSP82(Yeast)
Broad Institute

Curated by PubChem BioAssay
LigandPNGBDBM64546(4-ethyl-3-(2-methyl-5-thiophen-2-yl-thieno[2,3-d]p...)
Affinity DataEC50:  3.07E+4nMAssay Description:Keywords: Candida albicans, drug resistance, Fluconazole, Hsp90, stress response Assay Overview: Method for determining if compound acts as Hsp90 inh...More data for this Ligand-Target Pair
In Depth
Date in BDB:
7/10/2011
Entry Details
PCBioAssay
TargetATP-dependent molecular chaperone HSP82(Yeast)
Broad Institute

Curated by PubChem BioAssay
LigandPNGBDBM64546(4-ethyl-3-(2-methyl-5-thiophen-2-yl-thieno[2,3-d]p...)
Affinity DataEC50:  703nMAssay Description:Broad Institute: Reversing Antifungal Drug Resistance Project ID: 2037 Keywords: Candida albicans, drug resistance, Fluconazole, Hsp90, Calcineurin, ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
7/10/2011
Entry Details
PCBioAssay