BDBM80808 2-(2-amino-6-methylsulfanylpurin-9-yl)-N-[(1R)-1-naphthalen-1-ylethyl]acetamide::2-(2-azanyl-6-methylsulfanyl-purin-9-yl)-N-[(1R)-1-naphthalen-1-ylethyl]ethanamide::2-[2-amino-6-(methylthio)-9-purinyl]-N-[(1R)-1-(1-naphthalenyl)ethyl]acetamide::2-[2-amino-6-(methylthio)purin-9-yl]-N-[(1R)-1-(1-naphthyl)ethyl]acetamide::MLS002477170::SMR001399093::cid_44246604

SMILES CSc1nc(N)nc2n(CC(=O)N[C@H](C)c3cccc4ccccc34)cnc12

InChI Key InChIKey=SXHNKXCPTHKWFG-GFCCVEGCSA-N

Data  2 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 2 hits for monomerid = 80808   

TargetHexokinase-1(Homo sapiens (Human))
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM80808(2-(2-amino-6-methylsulfanylpurin-9-yl)-N-[(1R)-1-n...)
Affinity DataEC50:  1.18E+4nMAssay Description:Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails PCBioAssay
TargetHexokinase HKDC1 [W721R](Homo sapiens (Human))
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM80808(2-(2-amino-6-methylsulfanylpurin-9-yl)-N-[(1R)-1-n...)
Affinity DataEC50:  9.10E+3nMAssay Description:Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails PCBioAssay