BDBM50418448 CHEMBL1783248

SMILES: CCCNC(=O)c1nnc2c(cccc2c1N)-c1c(C)cccc1C

InChI Key: InChIKey=VOVGYBOEGUOGJQ-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 = 50418448   

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-2/beta-3/gamma-2 subunit (Homo sapiens (Human))	BDBM50418448 (CHEMBL1783248) Show SMILES CCCNC(=O)c1nnc2c(cccc2c1N)-c1c(C)cccc1C |(2.64,-18.71,;1.31,-19.48,;1.31,-21.02,;-.02,-21.79,;-1.35,-21.03,;-1.36,-19.49,;-2.69,-21.8,;-2.68,-23.36,;-4.02,-24.13,;-5.37,-23.36,;-6.7,-24.13,;-8.04,-23.36,;-8.04,-21.82,;-6.71,-21.05,;-5.37,-21.81,;-4.04,-21.02,;-4.05,-19.48,;-6.71,-25.67,;-5.38,-26.43,;-4.05,-25.66,;-5.38,-27.97,;-6.71,-28.74,;-8.05,-27.97,;-8.04,-26.43,;-9.37,-25.65,)| Show InChI InChI=1S/C20H22N4O/c1-4-11-22-20(25)19-17(21)15-10-6-9-14(18(15)23-24-19)16-12(2)7-5-8-13(16)3/h5-10H,4,11H2,1-3H3,(H2,21,23)(H,22,25)	PDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	8.51	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