BDBM50349753 CHEMBL1809180::US8822447, 54::US9771375, Example 54

SMILES CCc1nn(-c2ccccc2)c2cc(ccc12)N1CCN(C)CC1

InChI Key InChIKey=NTGSZZBWOJHHFG-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:
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Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50349753   

TargetKetohexokinase(Human)
Janssen Pharmaceutica

US Patent
LigandPNGBDBM50349753(CHEMBL1809180 | US8822447, 54 | US9771375, Example...)
Affinity DataIC50: 4.52E+3nMAssay Description:An enzymatic assay was developed to measure KHK-mediated conversion of D-fructose to Fructose-1-P (F-1-P) using High Throughput Mass Spectroscopy (HT...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/6/2019
Entry Details
US Patent

TargetKetohexokinase(Human)
Janssen Pharmaceutica

US Patent
LigandPNGBDBM50349753(CHEMBL1809180 | US8822447, 54 | US9771375, Example...)
Affinity DataIC50: 4.52E+3nMT: 2°CAssay Description:An enzymatic assay was developed to measure KHK-mediated conversion of D-fructose to Fructose-1-P (F-1-P) using High Throughput Mass Spectroscopy (HT...More data for this Ligand-Target Pair
In Depth
Date in BDB:
2/2/2015
Entry Details
US Patent

TargetKetohexokinase(Human)
Janssen Pharmaceutica

US Patent
LigandPNGBDBM50349753(CHEMBL1809180 | US8822447, 54 | US9771375, Example...)
Affinity DataIC50: 4.52E+3nMAssay Description:Inhibition of KHK-mediated conversion of D-fructose to fructose-1-phosphate after 60 mins by high throughput mass spectrometry analysisMore data for this Ligand-Target Pair
In Depth
Date in BDB:
3/23/2012
Entry Details Article
PubMed