BDBM33906 5-amino-1-(4-methoxybenzoyl)pyrazole-4-carbonitrile::5-amino-1-[(4-methoxyphenyl)-oxomethyl]-4-pyrazolecarbonitrile::5-amino-1-p-anisoyl-pyrazole-4-carbonitrile::5-azanyl-1-(4-methoxyphenyl)carbonyl-pyrazole-4-carbonitrile::MLS001005431::SMR000378089::cid_2405928

SMILES COc1ccc(cc1)C(=O)n1ncc(C#N)c1N

InChI Key InChIKey=WUANWHWUHPZKMS-UHFFFAOYSA-N

Data  3 IC50

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

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 33906   

TargetProthrombin(Human)
Pcmd

Curated by PubChem BioAssay
LigandPNGBDBM33906(SMR000378089 | 5-amino-1-[(4-methoxyphenyl)-oxomet...)
Affinity DataIC50: 1.51E+4nMpH: 7.5 T: 2°CAssay Description:HTS was performed using 217,350 compounds of the MLSCN library individually plated into 10ul 1536 compound plates at a concentration of 2.5 mM each, ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/9/2009
Entry Details
PCBioAssay
TargetCoagulation factor XII(Human)
Pcmd

Curated by PubChem BioAssay
LigandPNGBDBM33906(SMR000378089 | 5-amino-1-[(4-methoxyphenyl)-oxomet...)
Affinity DataIC50: 195nMAssay Description:Molecular Library Screening Center Network (MLSCN) Penn Center for Molecular Discovery (PCMD) Assay Provider: Scott L. Diamond, University of Pennsy...More data for this Ligand-Target Pair
In Depth
Date in BDB:
5/27/2011
Entry Details
PCBioAssay
TargetKallikrein-5(Human)
Pcmd

Curated by PubChem BioAssay
LigandPNGBDBM33906(SMR000378089 | 5-amino-1-[(4-methoxyphenyl)-oxomet...)
Affinity DataIC50: 84.4nMAssay Description:Molecular Library Screening Center Network (MLSCN) Penn Center for Molecular Discovery (PCMD) Assay Provider: Scott L. Diamond, University of Pennsy...More data for this Ligand-Target Pair
In Depth
Date in BDB:
6/8/2011
Entry Details
PCBioAssay