Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'GABA-A receptor; alpha-5/beta-3/gamma-2' and Ligand = 'BDBM50143129'   

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
GABA-A receptor; alpha-5/beta-3/gamma-2 (Homo sapiens (Human))	BDBM50143129 (6-phenyl-4,5,7,8-tetraazatetracyclo[9.3.2.02,10.03...) Show SMILES C(Oc1nn2c(nnc2c2C3CCC(CCC3)c12)-c1ccccc1)c1ccccn1 Show InChI InChI=1S/C24H23N5O/c1-2-7-18(8-3-1)22-26-27-23-20-16-9-6-10-17(13-12-16)21(20)24(28-29(22)23)30-15-19-11-4-5-14-25-19/h1-5,7-8,11,14,16-17H,6,9-10,12-13,15H2	PDB KEGG UniProtKB/SwissProt antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	1.20	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Merck Sharp and Dohme Research Laboratories Curated by ChEMBL					Assay Description Binding affinity for human GABA-A receptor alpha5-beta3-gamma2 subunits in L(tk-) cells				J Med Chem 47: 1807-22 (2004) Article DOI: 10.1021/jm031020p BindingDB Entry DOI: 10.7270/Q2959H0R
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