Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Gamma-aminobutyric acid type B receptor subunit 1' and Ligand = 'BDBM50113819'   

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 type B receptor subunit 1 (Rattus norvegicus (Rat))	BDBM50113819 (4-(4,4-Diphenyl-butyl)-5-piperidin-4-yl-isoxazol-3...) Show SMILES O=c1[nH]oc(C2CCNCC2)c1CCCC(c1ccccc1)c1ccccc1 Show InChI InChI=1S/C24H28N2O2/c27-24-22(23(28-26-24)20-14-16-25-17-15-20)13-7-12-21(18-8-3-1-4-9-18)19-10-5-2-6-11-19/h1-6,8-11,20-21,25H,7,12-17H2,(H,26,27)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
The Royal Danish School of Pharmacy Curated by ChEMBL					Assay Description Affinity for GABA-B receptor by inhibiting GABA uptake into rat brain synaptosomes				J Med Chem 45: 2454-68 (2002) BindingDB Entry DOI: 10.7270/Q2D21Z91
					More data for this Ligand-Target Pair