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Found 2 hits Enz. Inhib. hit(s) with Target = 'Sodium- and chloride-dependent betaine transporter' and Ligand = 'BDBM50021360'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Sodium- and chloride-dependent betaine transporter


(Mus musculus)
BDBM50021360
PNG
(CHEMBL3289575)
Show SMILES [#6]-[#7](-[#6]-[#6]\[#6]=[#6](/c1ccccc1)-c1ccccc1)-[#6](-[#6]-[#6]-[#7])-[#6](=O)-[#7]-[#6]-c1ccccc1Cl
Show InChI InChI=1S/C28H32ClN3O/c1-32(27(18-19-30)28(33)31-21-24-15-8-9-17-26(24)29)20-10-16-25(22-11-4-2-5-12-22)23-13-6-3-7-14-23/h2-9,11-17,27H,10,18-21,30H2,1H3,(H,31,33)
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CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 6.46E+3n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of mouse GAT2 expressed in human HEK293 cell line assessed as inhibition of [3H]GABA uptake measured after 40 mins by LC-ESI-MS/MS analysi...


Citation and Details

Article DOI: 10.1016/j.ejmech.2021.113512
BindingDB Entry DOI: 10.7270/Q2R21568
More data for this
Ligand-Target Pair
Sodium- and chloride-dependent betaine transporter


(Mus musculus)
BDBM50021360
PNG
(CHEMBL3289575)
Show SMILES [#6]-[#7](-[#6]-[#6]\[#6]=[#6](/c1ccccc1)-c1ccccc1)-[#6](-[#6]-[#6]-[#7])-[#6](=O)-[#7]-[#6]-c1ccccc1Cl
Show InChI InChI=1S/C28H32ClN3O/c1-32(27(18-19-30)28(33)31-21-24-15-8-9-17-26(24)29)20-10-16-25(22-11-4-2-5-12-22)23-13-6-3-7-14-23/h2-9,11-17,27H,10,18-21,30H2,1H3,(H,31,33)
Reactome pathway

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 6.46E+3n/an/an/an/an/an/a



Jagiellonian University Medical College

Curated by ChEMBL


Assay Description
Inhibition of mouse GAT2 expressed in HEK293 cells assessed as decrease in [3H]GABA uptake


Eur J Med Chem 83: 256-73 (2014)


Article DOI: 10.1016/j.ejmech.2014.06.024
BindingDB Entry DOI: 10.7270/Q21N82P9
More data for this
Ligand-Target Pair