BDBM50296420 CHEMBL558714::ethyl 2-(4-ethyl-5-((4-ethylphenoxy)methyl)-4H-1,2,4-triazol-3-ylthio)-3-methylbutanoate

SMILES CCOC(=O)C(Sc1nnc(COc2ccc(CC)cc2)n1CC)C(C)C

InChI Key InChIKey=RNCJWHBQJOYSEG-UHFFFAOYSA-N

Data  3 KI

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
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Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50296420   

TargetCarboxypeptidase B(Human)
Universitat Aut£Noma De Barcelona

Curated by ChEMBL
LigandPNGBDBM50296420(ethyl 2-(4-ethyl-5-((4-ethylphenoxy)methyl)-4H-1,2...)
Affinity DataKi:  1.08E+4nMAssay Description:Inhibition of human recombinant carboxypeptidase B expressed in Pichia pastoris systemMore data for this Ligand-Target Pair
In Depth
Date in BDB:
8/27/2010
Entry Details Article
PubMed
TargetCarboxypeptidase B(Corn earworm moth)
Universitat Aut£Noma De Barcelona

Curated by ChEMBL
LigandPNGBDBM50296420(ethyl 2-(4-ethyl-5-((4-ethylphenoxy)methyl)-4H-1,2...)
Affinity DataKi:  1.19E+4nMAssay Description:Inhibition of corn earworm recombinant carboxypeptidase B expressed in Pichia pastoris systemMore data for this Ligand-Target Pair
In Depth
Date in BDB:
8/27/2010
Entry Details Article
PubMed
TargetCarboxypeptidase A1(Bovine)
Universitat Aut£Noma De Barcelona

Curated by ChEMBL
LigandPNGBDBM50296420(ethyl 2-(4-ethyl-5-((4-ethylphenoxy)methyl)-4H-1,2...)
Affinity DataKi:  2.20E+4nMAssay Description:Inhibition of bovine carboxypeptidase A1More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/27/2010
Entry Details Article
PubMed