BDBM24815 Brassinin derivative, 3::N-[2-(1-benzothiophen-3-yl)ethyl](methylsulfanyl)carbothioamide

SMILES CSC(=S)NCCc1csc2ccccc12

InChI Key InChIKey=GCJGCNAYEGRSAX-UHFFFAOYSA-N

Data  1 KI

  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 1 hit for monomerid = 24815   

TargetIndoleamine 2,3-dioxygenase 1(Human)
Bryn Mawr College

LigandPNGBDBM24815(N-[2-(1-benzothiophen-3-yl)ethyl](methylsulfanyl)c...)
Affinity DataKi:  4.10E+4nM ΔG°:  -6.22kcal/molepH: 6.5 T: 2°CAssay Description:The IC50 inhibition assays were performed in a 96-well microtiter plate format using purified recombinant IDO, which was added to the substrate, L-tr...More data for this Ligand-Target Pair
In Depth
Date in BDB:
10/10/2008
Entry Details Article
PubMed