BDBM47512 1-(4-methylphenyl)-2-[[5-(8-quinolinyloxymethyl)-1,3,4-oxadiazol-2-yl]thio]ethanone::1-(4-methylphenyl)-2-[[5-(quinolin-8-yloxymethyl)-1,3,4-oxadiazol-2-yl]sulfanyl]ethanone::1-(p-tolyl)-2-[[5-(8-quinolyloxymethyl)-1,3,4-oxadiazol-2-yl]thio]ethanone::2-[5-(Quinolin-8-yloxymethyl)-[1,3,4]oxadiazol-2-ylsulfanyl]-1-p-tolyl-ethanone::MLS000071760::SMR000003497::cid_650551

SMILES Cc1ccc(cc1)C(=O)CSc1nnc(COc2cccc3cccnc23)o1

InChI Key InChIKey=BLNVPVBRBVPWPF-UHFFFAOYSA-N

Data  3 KI  1 EC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 47512   

TargetCarboxypeptidase B(Helicoverpa zea (Corn earworm moth) (Heliothis zea...)
Universitat AutÒnoma De Barcelona

LigandPNGBDBM47512(1-(4-methylphenyl)-2-[[5-(8-quinolinyloxymethyl)-1...)
Affinity DataKi:  1.40E+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 A1(Bos taurus (bovine))
Universitat AutÒnoma De Barcelona

LigandPNGBDBM47512(1-(4-methylphenyl)-2-[[5-(8-quinolinyloxymethyl)-1...)
Affinity DataKi:  3.20E+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

LigandPNGBDBM47512(1-(4-methylphenyl)-2-[[5-(8-quinolinyloxymethyl)-1...)
Affinity DataKi:  5.00E+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
TargetSolute carrier family 12 member 5(Homo sapiens (Human))
Vanderbilt Screening Center For Gpcrs, Ion Channels And Transporters

Curated by PubChem BioAssay
LigandPNGBDBM47512(1-(4-methylphenyl)-2-[[5-(8-quinolinyloxymethyl)-1...)
Affinity DataEC50:  8.12E+3nMAssay Description:Vanderbilt Screening Center for GPCRs, Ion Channels and Transporters Assay Provider: Eric Delpire Assay Provider Affliation: Vanderbilt University Gr...More data for this Ligand-Target Pair
In DepthDetails PCBioAssay