BDBM50448657 CHEMBL3127530::US9102669, 29

SMILES OCc1ccc(cc1)-c1ccc(nn1)N1CCC(CC1)N1CCc2ccc(F)cc12

InChI Key InChIKey=HKYOVUOYHSMXQS-UHFFFAOYSA-N

Data  3 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50448657   

TargetAcyl-CoA desaturase 1(Rat)
Janssen Pharmaceutica

US Patent
LigandPNGBDBM50448657(CHEMBL3127530 | US9102669, 29)
Affinity DataIC50: 7nMT: 2°CAssay Description:The SCD1 enzymatic assay was done in a volume of 50 μL using 10 μg of RLM (prepared as described above) in a 96-well polypropylene plate (e...More data for this Ligand-Target Pair
In DepthDetails
US Patent

TargetStearoyl-CoA desaturase(Human)
Janssen Research and Development

Curated by ChEMBL
LigandPNGBDBM50448657(CHEMBL3127530 | US9102669, 29)
Affinity DataIC50: 8nMAssay Description:Inhibition of SCD1 in human A431 cells assessed as [13C]-palmitic acid conversion to [13C]-palmitoleic acid after 4 hrs by LC/MS analysisMore data for this Ligand-Target Pair
In DepthDetails Article
PubMed
TargetAcyl-CoA desaturase 1(Rat)
Janssen Pharmaceutica

US Patent
LigandPNGBDBM50448657(CHEMBL3127530 | US9102669, 29)
Affinity DataIC50: 22nMAssay Description:Inhibition of SCD1 in Sprague-Dawley rat liver microsomes using stearoyl-[9,10-3H]-CoA as substrateMore data for this Ligand-Target Pair
In DepthDetails Article
PubMed