BDBM50378522 CHEMBL569261

SMILES: CCOC(=O)c1ncn-2c1Cc1cnc(nc1-c1ccccc-21)-c1ccccc1

InChI Key: InChIKey=DGSIOKGJBGEDNB-UHFFFAOYSA-N

Data: 1 KI

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50378522   

Target/Host (Institution)	Ligand	Target/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	pH	Temp °C
GABA receptor alpha-5/beta-3/gamma-2 subunit (Homo sapiens (Human))	BDBM50378522 (CHEMBL569261) Show SMILES CCOC(=O)c1ncn-2c1Cc1cnc(nc1-c1ccccc-21)-c1ccccc1 Show InChI InChI=1S/C23H18N4O2/c1-2-29-23(28)21-19-12-16-13-24-22(15-8-4-3-5-9-15)26-20(16)17-10-6-7-11-18(17)27(19)14-25-21/h3-11,13-14H,2,12H2,1H3	PDB KEGG UniProtKB/SwissProt antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	171	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
F. Hoffmann-La Roche Ltd Curated by ChEMBL					Assay Description Binding affinity to GABAA alpha-5-beta-3-gamma-2 receptor				Bioorg Med Chem Lett 19: 5746-52 (2009) Article DOI: 10.1016/j.bmcl.2009.07.153 BindingDB Entry DOI: 10.7270/Q2PR7WZC
					More data for this Ligand-Target Pair