BDBM212754 US9278954, 6.8 isomer 1::US9278954, 6.8 isomer 2::US9278954, 7.34

SMILES CCCOc1ccc(cc1)N1CC[C@H](C1)Oc1ccc(cc1)C(C)C(=O)NCC

InChI Key InChIKey=FZSCBLOZHIFZOA-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 = 212754   

TargetAcetyl-CoA carboxylase 2 [129-967](Human)
Boehringer Ingelheim International

US Patent
LigandPNGBDBM212754(US9278954, 6.8 isomer 2 | US9278954, 7.34 | US9278...)
Affinity DataIC50: 43nMpH: 7.5Assay Description:Malonyl CoA formation by acetyl CoA carboxylases is stoichometrically linked to the consumption of ATP. ACC2 activity is measured in a NADH-linked ki...More data for this Ligand-Target Pair
In Depth
Date in BDB:
2/13/2017
Entry Details
Go to US Patent

TargetAcetyl-CoA carboxylase 2 [129-967](Human)
Boehringer Ingelheim International

US Patent
LigandPNGBDBM212754(US9278954, 6.8 isomer 2 | US9278954, 7.34 | US9278...)
Affinity DataIC50: 789nMpH: 7.5Assay Description:Malonyl CoA formation by acetyl CoA carboxylases is stoichometrically linked to the consumption of ATP. ACC2 activity is measured in a NADH-linked ki...More data for this Ligand-Target Pair
In Depth
Date in BDB:
2/13/2017
Entry Details
Go to US Patent

TargetAcetyl-CoA carboxylase 2 [129-967](Human)
Boehringer Ingelheim International

US Patent
LigandPNGBDBM212754(US9278954, 6.8 isomer 2 | US9278954, 7.34 | US9278...)
Affinity DataIC50: 75nMpH: 7.5Assay Description:Malonyl CoA formation by acetyl CoA carboxylases is stoichometrically linked to the consumption of ATP. ACC2 activity is measured in a NADH-linked ki...More data for this Ligand-Target Pair
In Depth
Date in BDB:
2/13/2017
Entry Details
Go to US Patent