BDBM80749 1,4-Naphthalenedione, 5,8-dihydroxy-2,3-bis(hydroxymethyl)-::5,8-dihydroxy-6,7-bis(hydroxymethyl)naphthalene-1,4-dione::5,8-dihydroxy-6,7-dimethylol-1,4-naphthoquinone::6,7-bis(hydroxymethyl)-5,8-bis(oxidanyl)naphthalene-1,4-dione::MLS002703030::SMR001566838::cid_313371

SMILES OCc1c(O)c2C(=O)C=CC(=O)c2c(O)c1CO

InChI Key InChIKey=UKIJXKRMFLDSMY-UHFFFAOYSA-N

Data  2 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 2 hits for monomerid = 80749   

TargetHexokinase HKDC1 [W721R](Human)
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM80749(5,8-dihydroxy-6,7-bis(hydroxymethyl)naphthalene-1,...)
Affinity DataIC50: 1.52E+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
In Depth
Date in BDB:
8/3/2011
Entry Details
PCBioAssay
TargetHexokinase HKDC1 [W721R](Human)
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM80749(5,8-dihydroxy-6,7-bis(hydroxymethyl)naphthalene-1,...)
Affinity DataIC50: 8.00E+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
In Depth
Date in BDB:
8/4/2011
Entry Details
PCBioAssay