null

SMILES ClCC(=N)NCC#CC(=O)NCc1cccc(c1)-c1ccccc1

InChI Key InChIKey=TVWVXTPUYKCYDY-UHFFFAOYSA-N

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 50535202   

TargetProtein-arginine deiminase type-4(Homo sapiens (Human))
Yale University

Curated by ChEMBL
LigandPNGBDBM50535202(CHEMBL4546087)copy SMILEScopy InChI
Affinity DataIC50: 6.40E+4nMAssay Description:Inhibition of recombinant human GST-tagged PAD4 expressed in Escherichia coli BL21-DE3 pLysS assessed as reduction in reduction in residual activity ...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2Q243RFPubMed
TargetProtein-arginine deiminase type-2(Homo sapiens (Human))
Yale University

Curated by ChEMBL
LigandPNGBDBM50535202(CHEMBL4546087)copy SMILEScopy InChI
Affinity DataIC50: 1.53E+5nMAssay Description:Inhibition of recombinant human 6His-tagged PAD2 assessed as reduction in residual activity preincubated for 15 mins followed by addition of N-benzoy...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2Q243RFPubMed
TargetProtein-arginine deiminase type-3(Homo sapiens (Human))
Yale University

Curated by ChEMBL
LigandPNGBDBM50535202(CHEMBL4546087)copy SMILEScopy InChI
Affinity DataIC50: 6.50E+4nMAssay Description:Inhibition of recombinant human 6His-tagged PAD3 expressed in Escherichia coli BL21-DE3 pLysS assessed as reduction in residual activity preincubated...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2Q243RFPubMed
TargetProtein-arginine deiminase type-1(Homo sapiens (Human))
Yale University

Curated by ChEMBL
LigandPNGBDBM50535202(CHEMBL4546087)copy SMILEScopy InChI
Affinity DataIC50: 4.08E+5nMAssay Description:Inhibition of recombinant human 6His-tagged PAD1 assessed as reduction in residual activity preincubated for 15 mins followed by addition of N-benzoy...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2Q243RFPubMed