BDBM50146438 8-Ethylsulfanyl-3-methyl-5-pyridin-2-yl-3,4-dihydro-2H-naphthalen-1-one::CHEMBL95541

SMILES: CCSc1ccc(-c2ccccn2)c2CC(C)CC(=O)c12

InChI Key: InChIKey=GXYIMPYRUIKXIS-UHFFFAOYSA-N

Data: 4 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 4 hits for monomerid = 50146438   

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))	BDBM50146438 (8-Ethylsulfanyl-3-methyl-5-pyridin-2-yl-3,4-dihydr...) Show SMILES CCSc1ccc(-c2ccccn2)c2CC(C)CC(=O)c12 Show InChI InChI=1S/C18H19NOS/c1-3-21-17-8-7-13(15-6-4-5-9-19-15)14-10-12(2)11-16(20)18(14)17/h4-9,12H,3,10-11H2,1-2H3	PDB KEGG UniProtKB/SwissProt antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	1.90	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Merck Curated by ChEMBL					Assay Description Inhibition of [3H]-Ro- 15-1788 binding to human GABA-A receptor alpha-5-beta-3-gamma-2 subunits				Bioorg Med Chem Lett 14: 2871-5 (2004) Article DOI: 10.1016/j.bmcl.2004.03.054 BindingDB Entry DOI: 10.7270/Q2KW5GK5
					More data for this Ligand-Target Pair
GABA receptor alpha-2/beta-3/gamma-2 subunit (Homo sapiens (Human))	BDBM50146438 (8-Ethylsulfanyl-3-methyl-5-pyridin-2-yl-3,4-dihydr...) Show SMILES CCSc1ccc(-c2ccccn2)c2CC(C)CC(=O)c12 Show InChI InChI=1S/C18H19NOS/c1-3-21-17-8-7-13(15-6-4-5-9-19-15)14-10-12(2)11-16(20)18(14)17/h4-9,12H,3,10-11H2,1-2H3	PDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	13	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Merck Curated by ChEMBL					Assay Description Inhibition of [3H]-Ro- 15-1788 binding to recombinant human gamma-aminobutyric-acid A receptor alpha-2-beta-3-gamma-2				Bioorg Med Chem Lett 14: 2871-5 (2004) Article DOI: 10.1016/j.bmcl.2004.03.054 BindingDB Entry DOI: 10.7270/Q2KW5GK5
					More data for this Ligand-Target Pair
GABA receptor alpha-3/beta-3/gamma-2 subunit (Homo sapiens (Human))	BDBM50146438 (8-Ethylsulfanyl-3-methyl-5-pyridin-2-yl-3,4-dihydr...) Show SMILES CCSc1ccc(-c2ccccn2)c2CC(C)CC(=O)c12 Show InChI InChI=1S/C18H19NOS/c1-3-21-17-8-7-13(15-6-4-5-9-19-15)14-10-12(2)11-16(20)18(14)17/h4-9,12H,3,10-11H2,1-2H3	PDB UniProtKB/SwissProt antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	15	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Merck Curated by ChEMBL					Assay Description Inhibition of [3H]-Ro- 15-1788 binding to recombinant human gamma-aminobutyric-acid A receptor alpha-3-beta-3-gamma-2				Bioorg Med Chem Lett 14: 2871-5 (2004) Article DOI: 10.1016/j.bmcl.2004.03.054 BindingDB Entry DOI: 10.7270/Q2KW5GK5
					More data for this Ligand-Target Pair
GABA receptor alpha-1/beta-3/gamma-2 subunit (Homo sapiens (Human))	BDBM50146438 (8-Ethylsulfanyl-3-methyl-5-pyridin-2-yl-3,4-dihydr...) Show SMILES CCSc1ccc(-c2ccccn2)c2CC(C)CC(=O)c12 Show InChI InChI=1S/C18H19NOS/c1-3-21-17-8-7-13(15-6-4-5-9-19-15)14-10-12(2)11-16(20)18(14)17/h4-9,12H,3,10-11H2,1-2H3	PDB UniProtKB/SwissProt antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	25	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Merck Curated by ChEMBL					Assay Description Inhibition of [3H]-Ro- 15-1788 binding to recombinant human gamma-aminobutyric-acid A receptor alpha-1-beta-3-gamma-2				Bioorg Med Chem Lett 14: 2871-5 (2004) Article DOI: 10.1016/j.bmcl.2004.03.054 BindingDB Entry DOI: 10.7270/Q2KW5GK5
					More data for this Ligand-Target Pair