BDBM71104 2-chloranyl-1-[1-(4-methoxyphenyl)-2,5-dimethyl-pyrrol-3-yl]ethanone::2-chloro-1-[1-(4-methoxyphenyl)-2,5-dimethyl-3-pyrrolyl]ethanone::2-chloro-1-[1-(4-methoxyphenyl)-2,5-dimethyl-pyrrol-3-yl]ethanone::2-chloro-1-[1-(4-methoxyphenyl)-2,5-dimethylpyrrol-3-yl]ethanone::MLS001004925::SMR000348535::cid_2378291

SMILES COc1ccc(cc1)-n1c(C)cc(C(=O)CCl)c1C

InChI Key InChIKey=TTZHJRQFLDAYDP-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 = 71104   

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

Curated by PubChem BioAssay
LigandChemical structure of BindingDB Monomer ID 71104BDBM71104(2-chloranyl-1-[1-(4-methoxyphenyl)-2,5-dimethyl-py...)
Affinity DataIC50: 2.70E+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
LigandChemical structure of BindingDB Monomer ID 71104BDBM71104(2-chloranyl-1-[1-(4-methoxyphenyl)-2,5-dimethyl-py...)
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