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BDBM50491705 CHEMBL2387667

SMILES: OC(=O)C1CCCN(CCO\C=C/c2ccccc2Cc2ccccc2)C1

InChI Key: InChIKey=ZYHNOHYSMANAKL-QINSGFPZSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50491705   
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)		BDBM50491705
PNG
(CHEMBL2387667)
Show SMILES OC(=O)C1CCCN(CCO\C=C/c2ccccc2Cc2ccccc2)C1
Show InChI InChI=1S/C23H27NO3/c25-23(26)22-11-6-13-24(18-22)14-16-27-15-12-20-9-4-5-10-21(20)17-19-7-2-1-3-8-19/h1-5,7-10,12,15,22H,6,11,13-14,16-18H2,(H,25,26)/b15-12-
PDB

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PC cid
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Article
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n/an/a 398n/an/an/an/an/an/a



Ludwig-Maximilians-University Munich

Curated by ChEMBL


Assay Description
Inhibition of mouse GAT1 expressed in HEK cells assessed as inhibition of [3H]-GABA uptake after 25 mins by liquid scintillation counting analysis

Bioorg Med Chem 21: 3363-78 (2013)


Article DOI: 10.1016/j.bmc.2013.02.056
BindingDB Entry DOI: 10.7270/Q23N269C
More data for this
Ligand-Target Pair