Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Gamma-aminobutyric acid receptor subunit alpha-2/beta-2/gamma-2' and Ligand = 'BDBM50497206'   

Target/Host (Institution)	Ligand	Target/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	pH	Temp °C
Gamma-aminobutyric acid receptor subunit alpha-2/beta-2/gamma-2 (Homo sapiens (Human))	BDBM50497206 (CHEMBL3289195) Show SMILES CCCN(CCC)C(=O)\C=C\C=C\c1ccc2OCOc2c1 Show InChI InChI=1S/C18H23NO3/c1-3-11-19(12-4-2)18(20)8-6-5-7-15-9-10-16-17(13-15)22-14-21-16/h5-10,13H,3-4,11-12,14H2,1-2H3/b7-5+,8-6+	PDB KEGG UniProtKB/SwissProt antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	2.64E+4	n/a	n/a	n/a	n/a
University of Vienna Curated by ChEMBL					Assay Description Modulation of GABAA alpha2beta2gamma2S receptor (unknown origin) expressed in Xenopus laevis oocytes assessed as modulation of GABA-induced chloride ...				J Med Chem 57: 5602-19 (2014) Article DOI: 10.1021/jm5002277 BindingDB Entry DOI: 10.7270/Q25X2CXW
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