BDBM81908 3-(5-((naphthalen-1-yloxy)methyl)-4-pheny-4H-1,2,4-triazol-3-ythio)propanoic acid, 8

SMILES OC(=O)CCSc1nnc(COc2cccc3ccccc23)n1-c1ccccc1

InChI Key InChIKey=ONEYQUFCKREJEN-UHFFFAOYSA-N

Data  3 KI

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 81908   

TargetCarboxypeptidase A1(Bos taurus (bovine))
Universitat AutÒnoma De Barcelona

LigandPNGBDBM81908(3-(5-((naphthalen-1-yloxy)methyl)-4-pheny-4H-1,2,4...)
Affinity DataKi:  1.04E+4nMAssay Description:The aromatic compounds screening were characterized by molecular docking as well as by in vitro inhibition assay against carboxypeptidase(CPs) of dif...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCarboxypeptidase B2(Homo sapiens (Human))
Universitat AutÒnoma De Barcelona

LigandPNGBDBM81908(3-(5-((naphthalen-1-yloxy)methyl)-4-pheny-4H-1,2,4...)
Affinity DataKi:  1.18E+4nMAssay Description:The aromatic compounds screening were characterized by molecular docking as well as by in vitro inhibition assay against carboxypeptidase(CPs) of dif...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCarboxypeptidase B(Helicoverpa zea (Corn earworm moth) (Heliothis zea...)
Universitat AutÒnoma De Barcelona

LigandPNGBDBM81908(3-(5-((naphthalen-1-yloxy)methyl)-4-pheny-4H-1,2,4...)
Affinity DataKi:  3.50E+4nMAssay Description:The aromatic compounds screening were characterized by molecular docking as well as by in vitro inhibition assay against carboxypeptidase(CPs) of dif...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed