BDBM24825 (benzylsulfanyl)-N-(1H-indol-3-ylmethyl)carbothioamide::Brassinin derivative, 13

SMILES S=C(NCc1c[nH]c2ccccc12)SCc1ccccc1

InChI Key InChIKey=IFFQOFPVVYVJCA-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 = 24825   

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

LigandPNGBDBM24825((benzylsulfanyl)-N-(1H-indol-3-ylmethyl)carbothioa...)
Affinity DataKi:  1.32E+4nM ΔG°:  -6.92kcal/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