BDBM50204603 CHEMBL3907951

SMILES COc1cc(cc2nc(-c3cc4ccccc4n3CC(F)(F)F)n(C)c12)C(=O)N1CCC[C@@H](N)C1

InChI Key InChIKey=ATMQYASCICEAIR-UHFFFAOYSA-N

Data  2 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 2 hits for monomerid = 50204603   

TargetProtein-arginine deiminase type-2(Human)
Therachem Research Medilab (India)

Curated by ChEMBL
LigandPNGBDBM50204603(CHEMBL3907951)
Affinity DataIC50: 7.94E+4nMAssay Description:Inhibition of N-terminal 6His/FLAG-tagged recombinant human PAD2 (1 to 665 residues) expressed in baculovirus infected sf9 cells using N-a-benzoyl-L-...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/16/2018
Entry Details Article
PubMed
TargetProtein-arginine deiminase type-4(Human)
Therachem Research Medilab (India)

Curated by ChEMBL
LigandPNGBDBM50204603(CHEMBL3907951)
Affinity DataIC50: 50nMAssay Description:Inhibition of GST-tagged recombinant human PAD4 (1 to 663 residues) expressed in Escherichia coli using N-a-benzoyl-L-arginine ethyl ester as substra...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/16/2018
Entry Details Article
PubMed