BDBM31719 2-(4-Cyano-3-propyl-benzo[4,5]imidazo[1,2-a]pyridin-1-ylsulfanyl)-N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-d ihydro-1H-pyrazol-4-yl)-acetamide::2-(4-cyano-3-propyl-pyrido[1,2-a]benzimidazol-1-yl)sulfanyl-N-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)ethanamide::2-(4-cyano-3-propylpyrido[1,2-a]benzimidazol-1-yl)sulfanyl-N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)acetamide::2-[(4-cyano-3-propyl-1-pyrido[1,2-a]benzimidazolyl)thio]-N-(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)acetamide::2-[(4-cyano-3-propyl-pyrido[1,2-a]benzimidazol-1-yl)thio]-N-(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)acetamide::MLS000558438::SMR000148954::cid_3877694

SMILES CCCc1cc(SCC(=O)Nc2c(C)n(C)n(-c3ccccc3)c2=O)n2c(nc3ccccc23)c1C#N

InChI Key InChIKey=BIBFLLLNJYZYLQ-UHFFFAOYSA-N

Data  3 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 3 hits for monomerid = 31719   

TargetHeat shock 70 kDa protein 1A(Homo sapiens (Human))
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM31719(2-(4-Cyano-3-propyl-benzo[4,5]imidazo[1,2-a]pyridi...)
Affinity DataIC50:  1.00E+5nMpH: 7.0 T: 2°CAssay Description:Burnham Center for Chemical Genomics (BCCG) Burnham Institute for Medical Research (San Diego, CA) NIH Molecular Libraries Screening Centers Network ...More data for this Ligand-Target Pair
In DepthDetails PCBioAssay
TargetHeat shock cognate 71 kDa protein(Homo sapiens (Human))
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM31719(2-(4-Cyano-3-propyl-benzo[4,5]imidazo[1,2-a]pyridi...)
Affinity DataIC50:  9.99E+5nMAssay Description:Sanford-Burnham Center for Chemical Genomics (SBCCG) Sanford-Burnham Medical Research Institute (San Diego, CA) NIH Molecular Libraries Screening Cen...More data for this Ligand-Target Pair
In DepthDetails PCBioAssay
TargetHeat shock 70 kDa protein 1A(Homo sapiens (Human))
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM31719(2-(4-Cyano-3-propyl-benzo[4,5]imidazo[1,2-a]pyridi...)
Affinity DataIC50: >1.00E+5nMAssay Description:Sanford-Burnham Center for Chemical Genomics (SBCCG) Sanford-Burnham Medical Research Institute (San Diego, CA) NIH Molecular Libraries Screening Cen...More data for this Ligand-Target Pair
In DepthDetails PCBioAssay