BDBM33440 1-(5-amino-3-phenyl-1,2,4-triazol-1-yl)-2-phenyl-ethanone::1-(5-amino-3-phenyl-1,2,4-triazol-1-yl)-2-phenylethanone::1-(5-azanyl-3-phenyl-1,2,4-triazol-1-yl)-2-phenyl-ethanone::3-phenyl-1-(phenylacetyl)-1H-1,2,4-triazol-5-amine::MLS000099520::SMR000074206::cid_969682

SMILES Nc1nc(nn1C(=O)Cc1ccccc1)-c1ccccc1

InChI Key InChIKey=OWRFGLQQIWZWDX-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 = 33440   

TargetCoagulation factor XII(Homo sapiens (Human))
Pcmd

Curated by PubChem BioAssay
LigandPNGBDBM33440(1-(5-amino-3-phenyl-1,2,4-triazol-1-yl)-2-phenyl-e...)
Affinity DataIC50:  3.21E+3nMpH: 7.4 T: 2°CAssay Description:HTS was performed on a total of 33,068 compounds of the MLSCN library, 23,017 of which were not in the mixture HTS plates used previously. These comp...More data for this Ligand-Target Pair
In DepthDetails PCBioAssay
TargetCoagulation factor XII(Homo sapiens (Human))
Pcmd

Curated by PubChem BioAssay
LigandPNGBDBM33440(1-(5-amino-3-phenyl-1,2,4-triazol-1-yl)-2-phenyl-e...)
Affinity DataIC50:  3.21E+3nMAssay 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 DepthDetails PCBioAssay
TargetProthrombin(Homo sapiens (Human))
Pcmd

Curated by PubChem BioAssay
LigandPNGBDBM33440(1-(5-amino-3-phenyl-1,2,4-triazol-1-yl)-2-phenyl-e...)
Affinity DataIC50:  1.51E+3nMpH: 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 DepthDetails PCBioAssay