BDBM44445 3-(1,3-benzodioxol-5-ylmethyl)-7-(piperidin-1-ylcarbonyl)-2-thioxo-2,3-dihydroquinazolin-4(1H)-one::3-(1,3-benzodioxol-5-ylmethyl)-7-(piperidine-1-carbonyl)-2-sulfanylidene-1H-quinazolin-4-one::3-(1,3-benzodioxol-5-ylmethyl)-7-[oxo(1-piperidinyl)methyl]-2-sulfanylidene-1H-quinazolin-4-one::3-(1,3-benzodioxol-5-ylmethyl)-7-piperidin-1-ylcarbonyl-2-sulfanylidene-1H-quinazolin-4-one::7-(piperidine-1-carbonyl)-3-piperonyl-2-thioxo-1H-quinazolin-4-one::MLS000095530::SMR000031083::cid_3237126

SMILES O=C(N1CCCCC1)c1ccc2c(c1)[nH]c(=S)n(Cc1ccc3OCOc3c1)c2=O

InChI Key InChIKey=JSBZTARYHDVIJV-UHFFFAOYSA-N

Data  4 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 44445   

TargetEphrin type-A receptor 4(Mus musculus)
Sanford-Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM44445(3-(1,3-benzodioxol-5-ylmethyl)-7-(piperidin-1-ylca...)
Affinity DataIC50: >1.00E+5nMAssay 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
TargetPhosphomannomutase 2(Homo sapiens (Human))
Sanford-Burnham Medical Research Institute

Curated by ChEMBL
LigandPNGBDBM44445(3-(1,3-benzodioxol-5-ylmethyl)-7-(piperidin-1-ylca...)
Affinity DataIC50:  3.13E+4nMAssay Description:Inhibition of human purified PMM2More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetMannose-6-phosphate isomerase(Homo sapiens (Human))
Sanford-Burnham Medical Research Institute

Curated by ChEMBL
LigandPNGBDBM44445(3-(1,3-benzodioxol-5-ylmethyl)-7-(piperidin-1-ylca...)
Affinity DataIC50:  1.90E+3nMAssay Description:Inhibition of human purified phosphomannose isomeraseMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetEphrin type-A receptor 4(Mus musculus)
Sanford-Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM44445(3-(1,3-benzodioxol-5-ylmethyl)-7-(piperidin-1-ylca...)
Affinity DataIC50: >5.00E+4nMAssay Description:Sanford-Burnham Center for Chemical Genomics (SBCCG) Sanford-Burnham Medical Research Institute (SBMRI, San Diego, CA) NIH Molecular Libraries Screen...More data for this Ligand-Target Pair
In DepthDetails PCBioAssay