BDBM24818 Brassinin derivative, 6::N-(adamantan-2-yl)(methylsulfanyl)carbothioamide

SMILES CSC(=S)NC1C2CC3CC(C2)CC1C3

InChI Key InChIKey=GLEUVPIIIJOINY-UHFFFAOYSA-N

Data  1 KI

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 24818   

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

LigandPNGBDBM24818(Brassinin derivative, 6 | N-(adamantan-2-yl)(methy...)
Affinity DataKi:  1.80E+5nM ΔG°:  -5.31kcal/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
Ligand InfoPC cidPC sid
In DepthDetails ArticlePubMed