BDBM33843 (5-amino-3-pyridin-3-yl-1,2,4-triazol-1-yl)-(4-fluorophenyl)methanone::(5-azanyl-3-pyridin-3-yl-1,2,4-triazol-1-yl)-(4-fluorophenyl)methanone::1-(4-fluorobenzoyl)-3-(3-pyridinyl)-1H-1,2,4-triazol-5-amine::MLS000665897::SMR000294586::[5-amino-3-(3-pyridinyl)-1,2,4-triazol-1-yl]-(4-fluorophenyl)methanone::[5-amino-3-(3-pyridyl)-1,2,4-triazol-1-yl]-(4-fluorophenyl)methanone::cid_972160

SMILES Nc1nc(nn1C(=O)c1ccc(F)cc1)-c1cccnc1

InChI Key InChIKey=FXRFMCDLHSKARY-UHFFFAOYSA-N

Data  2 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 2 hits for monomerid = 33843   

TargetProthrombin(Human)
Pcmd

Curated by PubChem BioAssay
LigandPNGBDBM33843(SMR000294586 | [5-amino-3-(3-pyridinyl)-1,2,4-tria...)
Affinity DataIC50: 2.01E+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 Depth
Date in BDB:
11/9/2009
Entry Details
PCBioAssay
TargetCoagulation factor XII(Human)
Pcmd

Curated by PubChem BioAssay
LigandPNGBDBM33843(SMR000294586 | [5-amino-3-(3-pyridinyl)-1,2,4-tria...)
Affinity DataIC50: 80.8nMAssay 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