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SMILES: Cc1ccsc1\C(=N\OCCN1CCC[C@H](C1)C(O)=O)c1ccc(Cl)cc1Cl

InChI Key: InChIKey=BPGDHEBMTPGQRT-CGUCZKFASA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50080365   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kcal/mole		IC50
nM		Kd
nM		EC50/IC50
nM		koff
s-1		kon
M-1s-1		pHTemp
°C
Sodium- and chloride-dependent GABA transporter 1


(Rattus norvegicus)		BDBM50080365
PNG
((R)-1-{2-[1-(2,4-Dichloro-phenyl)-1-(3-methyl-thio...)
Show SMILES Cc1ccsc1\C(=N\OCCN1CCC[C@H](C1)C(O)=O)c1ccc(Cl)cc1Cl
Show InChI InChI=1S/C20H22Cl2N2O3S/c1-13-6-10-28-19(13)18(16-5-4-15(21)11-17(16)22)23-27-9-8-24-7-2-3-14(12-24)20(25)26/h4-6,10-11,14H,2-3,7-9,12H2,1H3,(H,25,26)/b23-18+/t14-/m1/s1
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Similars
Article
PubMed
 32n/an/an/an/an/an/an/an/a



Novo Nordisk A/S

Curated by ChEMBL


Assay Description
In vitro inhibition of [3H]GABA uptake at the Sodium- and chloride-dependent GABA transporter 1 (GAT-1) uptake site in rat brain synaptosomes

J Med Chem 42: 3447-62 (1999)


Article DOI: 10.1021/jm981027k
BindingDB Entry DOI: 10.7270/Q2057GMV
More data for this
Ligand-Target Pair