BDBM50355658 CHEMBL1910973

SMILES NC(=O)[C@H](CCCN=C(N)CF)NC(=O)c1ccccc1

InChI Key InChIKey=OLFDULIIJWCYCK-UHFFFAOYSA-N

Data  3 KI  4 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 7 hits for monomerid = 50355658   

TargetProtein-arginine deiminase type-1(Human)
The Scripps Research Institute

Curated by ChEMBL
LigandPNGBDBM50355658(CHEMBL1910973)
Affinity DataIC50: 2.90E+4nMAssay Description:Irreversible inhibition of PAD1 assessed as hydrolysis of benzoyl-L-arginine ethyl ester preincubated for 15 mins measured after 15 mins by fluoromet...More data for this Ligand-Target Pair
In Depth
Date in BDB:
7/20/2012
Entry Details Article
PubMed
TargetProtein-arginine deiminase type-3(Human)
The Scripps Research Institute

Curated by ChEMBL
LigandPNGBDBM50355658(CHEMBL1910973)
Affinity DataIC50: 3.67E+5nMAssay Description:Irreversible inhibition of PAD3 assessed as hydrolysis of benzoyl-L-arginine ethyl ester preincubated for 15 mins measured after 15 mins by fluoromet...More data for this Ligand-Target Pair
In Depth
Date in BDB:
7/20/2012
Entry Details Article
PubMed
TargetProtein-arginine deiminase type-2(Human)
The Scripps Research Institute

Curated by ChEMBL
LigandPNGBDBM50355658(CHEMBL1910973)
Affinity DataIC50: 5.10E+4nMAssay Description:Irreversible inhibition of PAD2 assessed as hydrolysis of benzoyl-L-arginine ethyl ester preincubated for 15 mins measured after 15 mins by fluoromet...More data for this Ligand-Target Pair
In Depth
Date in BDB:
7/20/2012
Entry Details Article
PubMed
TargetProtein-arginine deiminase type-4(Human)
The Scripps Research Institute

Curated by ChEMBL
LigandPNGBDBM50355658(CHEMBL1910973)
Affinity DataIC50: 2.20E+4nMAssay Description:Irreversible inhibition of PAD4 assessed as hydrolysis of benzoyl-L-arginine ethyl ester preincubated for 15 mins measured after 15 mins by fluoromet...More data for this Ligand-Target Pair
In Depth
Date in BDB:
7/20/2012
Entry Details Article
PubMed
TargetProtein-arginine deiminase type-3(Human)
The Scripps Research Institute

Curated by ChEMBL
LigandPNGBDBM50355658(CHEMBL1910973)
Affinity DataKi:  2.93E+5nMAssay Description:Irreversible inhibition of PAD3 assessed as hydrolysis of benzoyl-L-arginine ethyl ester preincubated for 15 mins measured after 15 mins by fluoromet...More data for this Ligand-Target Pair
In Depth
Date in BDB:
7/20/2012
Entry Details Article
PubMed
TargetProtein-arginine deiminase type-4(Human)
The Scripps Research Institute

Curated by ChEMBL
LigandPNGBDBM50355658(CHEMBL1910973)
Affinity DataKi:  3.30E+5nMAssay Description:Irreversible inhibition of PAD4 assessed as hydrolysis of benzoyl-L-arginine ethyl ester preincubated for 15 mins measured after 15 mins by fluoromet...More data for this Ligand-Target Pair
In Depth
Date in BDB:
7/20/2012
Entry Details Article
PubMed
TargetProtein-arginine deiminase type-1(Human)
The Scripps Research Institute

Curated by ChEMBL
LigandPNGBDBM50355658(CHEMBL1910973)
Affinity DataKi:  1.10E+5nMAssay Description:Irreversible inhibition of PAD1 assessed as hydrolysis of benzoyl-L-arginine ethyl ester preincubated for 15 mins measured after 15 mins by fluoromet...More data for this Ligand-Target Pair
In Depth
Date in BDB:
7/20/2012
Entry Details Article
PubMed