BDBM501577 US11026937, Compound I-145

SMILES COc1nc2ccccc2c(-c2ccccc2)c1C(=O)\C=C\c1ccccn1

InChI Key InChIKey=WFIYFDIGJLTFLH-CCEZHUSRSA-N

Data  1 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
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Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 501577   

TargetProtein-arginine deiminase type-4(Homo sapiens (Human))
Padlock Therapeutics

US Patent
LigandPNGBDBM501577(US11026937, Compound I-145)
Affinity DataIC50:  7.00E+4nMAssay Description:Assay buffer (as aforementioned): 100 mM Tris-HCl (pH 7.6), 2 mM DTT, 1 mM CaCl2Final concentrations:100 nM hPAD4 enzyme50 μM (8-fold sub-Km) su...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails US Patent