BDBM50418471 CHEMBL1783270

SMILES: COc1ccc(OC)c(c1)-c1cccc2c(N)c3c(cn(C4CC4)c3=O)[nH]c12

InChI Key: InChIKey=FTCIEMQQEORZHD-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 = 50418471   

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
Gamma-aminobutyric acid receptor subunit alpha-2/beta-3/gamma-2 (Homo sapiens (Human))	BDBM50418471 (CHEMBL1783270) Show SMILES COc1ccc(OC)c(c1)-c1cccc2c(N)c3c(cn(C4CC4)c3=O)[nH]c12 Show InChI InChI=1S/C22H21N3O3/c1-27-13-8-9-18(28-2)16(10-13)14-4-3-5-15-20(23)19-17(24-21(14)15)11-25(22(19)26)12-6-7-12/h3-5,8-12,24H,6-7,23H2,1-2H3	PDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	33.1	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
AstraZeneca Curated by ChEMBL					Assay Description Displacement of [3H]flunitrazepam from benzodiazepine binding site GABAA alpha2beta3gamma2 receptor expressed in Sf9 cells after 1 hr				Bioorg Med Chem 19: 2927-38 (2011) Article DOI: 10.1016/j.bmc.2011.03.035 BindingDB Entry DOI: 10.7270/Q29S1S98
					More data for this Ligand-Target Pair