Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Gamma-aminobutyric acid receptor subunit alpha-1/beta-2/gamma-2' and Ligand = 'BDBM50493004'   

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-1/beta-2/gamma-2 (Homo sapiens (Human))	BDBM50493004 (CHEMBL2420449) Show SMILES On1cc(C2CCNCC2)c(n1)-c1c[nH]c(n1)-c1ccccc1 Show InChI InChI=1S/C17H19N5O/c23-22-11-14(12-6-8-18-9-7-12)16(21-22)15-10-19-17(20-15)13-4-2-1-3-5-13/h1-5,10-12,18,23H,6-9H2,(H,19,20)	PDB UniProtKB/SwissProt antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	9.70E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Copenhagen Curated by ChEMBL					Assay Description Antagonist activity at human alpha1beta2gamma2S GABA-A receptor expressed in tsA201 cells assessed as inhibition of GABA-induced effect after 30 mins...				J Med Chem 56: 6536-40 (2013) Article DOI: 10.1021/jm4006466 BindingDB Entry DOI: 10.7270/Q2K35XKM
					More data for this Ligand-Target Pair
Gamma-aminobutyric acid receptor subunit alpha-1/beta-2/gamma-2 (Homo sapiens (Human))	BDBM50493004 (CHEMBL2420449) Show SMILES On1cc(C2CCNCC2)c(n1)-c1c[nH]c(n1)-c1ccccc1 Show InChI InChI=1S/C17H19N5O/c23-22-11-14(12-6-8-18-9-7-12)16(21-22)15-10-19-17(20-15)13-4-2-1-3-5-13/h1-5,10-12,18,23H,6-9H2,(H,19,20)	PDB UniProtKB/SwissProt antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	9.77E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Copenhagen Curated by ChEMBL					Assay Description Antagonist activity at human alpha1beta2gamma2S GABA-A receptor expressed in tsA201 cells assessed as inhibition of GABA-induced effect after 30 mins...				J Med Chem 56: 6536-40 (2013) Article DOI: 10.1021/jm4006466 BindingDB Entry DOI: 10.7270/Q2K35XKM
					More data for this Ligand-Target Pair