BDBM80736 4-[[1-oxo-2-[[6-(2-pyridinyl)-3-pyridazinyl]thio]ethyl]amino]benzoic acid ethyl ester::4-[[2-[[6-(2-pyridyl)pyridazin-3-yl]thio]acetyl]amino]benzoic acid ethyl ester::MLS001237525::SMR000807382::cid_16019317::ethyl 4-[2-(6-pyridin-2-ylpyridazin-3-yl)sulfanylethanoylamino]benzoate::ethyl 4-[[2-(6-pyridin-2-ylpyridazin-3-yl)sulfanylacetyl]amino]benzoate

SMILES CCOC(=O)c1ccc(NC(=O)CSc2ccc(nn2)-c2ccccn2)cc1

InChI Key InChIKey=RTBRGZJBQODUKJ-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 = 80736   

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

Curated by PubChem BioAssay
LigandPNGBDBM80736(4-[[1-oxo-2-[[6-(2-pyridinyl)-3-pyridazinyl]thio]e...)
Affinity DataIC50:  2.15E+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
In DepthDetails PCBioAssay
TargetHexokinase HKDC1 [W721R](Homo sapiens (Human))
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM80736(4-[[1-oxo-2-[[6-(2-pyridinyl)-3-pyridazinyl]thio]e...)
Affinity DataIC50:  2.31E+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
In DepthDetails PCBioAssay