BDBM50175787 1-(4,4-bis(3-(isopropoxymethyl)thiophen-2-yl)but-3-enyl)piperidine-4-carboxylic acid hydrochloride::CHEMBL540623

SMILES [#6]-[#6](-[#6])-[#8]-[#6]-c1ccsc1\[#6](=[#6]/[#6]-[#6]-[#7]-1-[#6]-[#6]-[#6](-[#6]-[#6]-1)-[#6](-[#8])=O)-c1sccc1-[#6]-[#8]-[#6](-[#6])-[#6]

InChI Key InChIKey=YEKPSJKCEXQDBC-UHFFFAOYSA-N

Data  1 IC50

  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 1 hit for monomerid = 50175787   

TargetSodium- and chloride-dependent GABA transporter 1(Human)
Fudan University

Curated by ChEMBL
LigandPNGBDBM50175787(1-(4,4-bis(3-(isopropoxymethyl)thiophen-2-yl)but-3...)
Affinity DataIC50: 1.00E+5nMAssay Description:Inhibition of GAT1 transport activityMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/5/2012
Entry Details Article
PubMed