BDBM80734 MLS001167223::N-[2-(2-keto-6,7-dimethyl-1H-quinolin-3-yl)ethyl]-4-pyrrolidinosulfonyl-benzamide::N-[2-(6,7-dimethyl-2-oxidanylidene-1H-quinolin-3-yl)ethyl]-4-pyrrolidin-1-ylsulfonyl-benzamide::N-[2-(6,7-dimethyl-2-oxo-1H-quinolin-3-yl)ethyl]-4-(1-pyrrolidinylsulfonyl)benzamide::N-[2-(6,7-dimethyl-2-oxo-1H-quinolin-3-yl)ethyl]-4-pyrrolidin-1-ylsulfonylbenzamide::SMR000805961::cid_4435623

SMILES Cc1cc2cc(CCNC(=O)c3ccc(cc3)S(=O)(=O)N3CCCC3)c(=O)[nH]c2cc1C

InChI Key InChIKey=HSUSFCCXSLOKOO-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 = 80734   

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

Curated by PubChem BioAssay
LigandPNGBDBM80734(N-[2-(6,7-dimethyl-2-oxo-1H-quinolin-3-yl)ethyl]-4...)
Affinity DataIC50: 1.36E+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
LigandPNGBDBM80734(N-[2-(6,7-dimethyl-2-oxo-1H-quinolin-3-yl)ethyl]-4...)
Affinity DataIC50: 1.50E+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