BDBM50429 (6E)-6-[[(3-ethyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)amino]methylidene]-4-methoxy-2-nitro-1-cyclohexa-2,4-dienone::(6E)-6-[[(3-ethyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)amino]methylidene]-4-methoxy-2-nitro-cyclohexa-2,4-dien-1-one::(6E)-6-[[(3-ethyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)amino]methylidene]-4-methoxy-2-nitrocyclohexa-2,4-dien-1-one::(6E)-6-[[(3-ethyl-5-thioxo-1H-1,2,4-triazol-4-yl)amino]methylene]-4-methoxy-2-nitro-cyclohexa-2,4-dien-1-one::5-ethyl-4-({2-hydroxy-3-nitro-5-methoxybenzylidene}amino)-2,4-dihydro-3H-1,2,4-triazole-3-thione::MLS000705162::SMR000230376::cid_6167174

SMILES CCc1n[nH]c(=S)n1[NH+]=C[c-]1cc(OC)cc([N+]([O-])=O)c1=O

InChI Key InChIKey=XIZWYXNABXYECJ-UHFFFAOYSA-O

Data  3 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 3 hits for monomerid = 50429   

LigandPNGBDBM50429((6E)-6-[[(3-ethyl-5-sulfanylidene-1H-1,2,4-triazol...)
Affinity DataIC50: 1.24E+4nMAssay Description:NIH Molecular Libraries Screening Centers Network [MLSCN] Emory Chemical Biology Discovery Center in MLSCN Assay provider: Nikolovska-Coleska, Univer...More data for this Ligand-Target Pair
In Depth
Date in BDB:
5/30/2011
Entry Details
PCBioAssay
TargetT cell receptor alpha variable 4(Human)
The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay
LigandPNGBDBM50429((6E)-6-[[(3-ethyl-5-sulfanylidene-1H-1,2,4-triazol...)
Affinity DataIC50: 1.84E+4nMMore data for this Ligand-Target Pair
In Depth
Date in BDB:
6/21/2013
Entry Details
PCBioAssay
TargetAlbumin(Bovine)
The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay
LigandPNGBDBM50429((6E)-6-[[(3-ethyl-5-sulfanylidene-1H-1,2,4-triazol...)
Affinity DataIC50: 9.41E+4nMMore data for this Ligand-Target Pair
In Depth
Date in BDB:
6/21/2013
Entry Details
PCBioAssay