BDBM50118614 CHEMBL3617088

SMILES CCCC1=CC(=O)n2c(c(c(n2)CC(=O)N3CCCC3)C#N)N1

InChI Key InChIKey=IBJDXQJWRXJZBH-UHFFFAOYSA-N

Data  2 IC50

PDB links: 1 PDB ID matches this monomer.

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50118614   

LigandPNGBDBM50118614(CHEMBL3617088)
Affinity DataIC50: 1.00E+4nMAssay Description:Inhibition of BCATm in differentiated primary human adipocytes assessed as remaining leucine level by reversed phase HPLC analysisMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/1/2016
Entry Details Article
PubMedPDB3D3D Structure (crystal)
LigandPNGBDBM50118614(CHEMBL3617088)
Affinity DataIC50: 501nMAssay Description:Inhibition of human cloned BCATm expressed in Escherichia coli BL21 DE3 assessed as L-glutamate production from alpha-ketoglutarate after 10 mins by ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
12/1/2016
Entry Details Article
PubMedPDB3D3D Structure (crystal)