BDBM349944 (S)-5-(4-(2-(4-chlorobenzyl)-4-(methylsulfonyl)piperazin-1-yl)piperidin-1-yl)-4H-1,2,4-triazol-3-amine ::US10208020, Example 34

SMILES CS(=O)(=O)N1CCN([C@@H](Cc2ccc(Cl)cc2)C1)C1CCN(CC1)c1nnc(N)[nH]1

InChI Key InChIKey=PQJIVUSMTSTCRY-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 = 349944   

TargetAcidic mammalian chitinase(Human)
Oncoarendi Therapeutics

US Patent
LigandChemical structure of BindingDB Monomer ID 349944BDBM349944((S)-5-(4-(2-(4-chlorobenzyl)-4-(methylsulfonyl)pip...)
Affinity DataIC50: 5.50E+3nMAssay Description:An enzymatic assay with recombinant human AMCase was used in order to establish inhibitory activity of the compounds (Boot et al., 2001, JBC: 276). T...More data for this Ligand-Target Pair
In Depth
Date in BDB:
9/21/2019
Entry Details
US Patent

TargetChitotriosidase-1(Human)
Oncoarendi Therapeutics

US Patent
LigandChemical structure of BindingDB Monomer ID 349944BDBM349944((S)-5-(4-(2-(4-chlorobenzyl)-4-(methylsulfonyl)pip...)
Affinity DataIC50: 5.50E+4nMAssay Description:An enzymatic assay with recombinant human CHIT1 was used in order to establish inhibitory activity of the compounds (Boot et al., 2001, JBC: 276). Th...More data for this Ligand-Target Pair
In Depth
Date in BDB:
9/21/2019
Entry Details
US Patent