BDBM50118629 CHEMBL3617091

SMILES CCC1=CC(=O)n2c(c(c(n2)C)C#N)N1

InChI Key InChIKey=BEASIHRTQREINR-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 = 50118629   

LigandPNGBDBM50118629(CHEMBL3617091)
Affinity DataIC50: 6.31E+5nMAssay 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)
LigandPNGBDBM50118629(CHEMBL3617091)
Affinity DataIC50: 6.31E+5nMAssay Description:Inhibition of human BCATm incubated for 10 mins by Amplex red- based fluorescence analysisMore data for this Ligand-Target Pair
In Depth
Date in BDB:
8/8/2017
Entry Details Article
PubMedPDB3D3D Structure (crystal)