BDBM513901 7-{1-[1-(3,3-Difluorocyclopentyl)-1H-pyrazol-4-yl]-3-{[trans-4-phenylcyclohexyl]amino}propyl}-3H-[1,2,3]triazolo[4,5-b]pyridin-5-amine, 2TFA::US11059818, Example 27

SMILES Ic1cnn(c1)C1CCC(=O)C1

InChI Key InChIKey=YDVGZAUGDBWZKW-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 = 513901   

TargetMyeloperoxidase(Human)
Bristol-Myers Squibb

US Patent
LigandPNGBDBM513901(7-{1-[1-(3,3-Difluorocyclopentyl)-1H-pyrazol-4-yl]...)
Affinity DataIC50: 50nMAssay Description:MPO chlorination activity was measured in 100 mM KPi (pH 7.4) by utilizing the non-fluorescent reagent Aminophenyl fluorescein (APF, Invitrogen Cat. ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
2/2/2022
Entry Details
US Patent

TargetMyeloperoxidase(Human)
Bristol-Myers Squibb

US Patent
LigandPNGBDBM513901(7-{1-[1-(3,3-Difluorocyclopentyl)-1H-pyrazol-4-yl]...)
Affinity DataIC50: 550nMAssay Description:MPO peroxidation activity was measured in 100 mM KPi (pH 7.4) by utilizing the non-fluorescent reagent Amplex Red (Invitrogen Cat. #A12222) which can...More data for this Ligand-Target Pair
In Depth
Date in BDB:
2/2/2022
Entry Details
US Patent