BDBM50162188 5-methyl-1,3-thiazol-4-yl[6-phenyl-4,5,7,8-tetraazatetracyclo[9.2.2.02,10.03,7]pentadeca-2(10),3,5,8-tetraen-9-yloxy]methane::CHEMBL359545

SMILES: Cc1scnc1COc1nn2c(nnc2c2C3CCC(CC3)c12)-c1ccccc1

InChI Key: InChIKey=HRVCUISAJOBFTQ-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 = 50162188   

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))	BDBM50162188 (5-methyl-1,3-thiazol-4-yl[6-phenyl-4,5,7,8-tetraaz...) Show SMILES Cc1scnc1COc1nn2c(nnc2c2C3CCC(CC3)c12)-c1ccccc1 |(-2.26,-4.74,;-.79,-5.23,;-.32,-6.68,;1.22,-6.68,;1.71,-5.23,;.45,-4.32,;.45,-2.76,;-.88,-2.01,;-.88,-.47,;.45,.3,;.45,1.84,;1.62,2.91,;.96,4.26,;-.55,4.12,;-.88,2.61,;-2.21,1.84,;-3.56,2.51,;-4.87,1.84,;-4.87,.3,;-3.54,-.47,;-4.47,1.07,;-2.91,1.07,;-2.21,.3,;3.11,2.59,;3.6,1.16,;5.12,.86,;6.12,2.01,;5.63,3.47,;4.11,3.77,)| Show InChI InChI=1S/C22H21N5OS/c1-13-17(23-12-29-13)11-28-22-19-15-9-7-14(8-10-15)18(19)21-25-24-20(27(21)26-22)16-5-3-2-4-6-16/h2-6,12,14-15H,7-11H2,1H3	PDB KEGG UniProtKB/SwissProt antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	0.770	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Merck Sharp & Dohme Research Laboratories Curated by ChEMBL					Assay Description Inhibition of [3H]-Ro-15-1788 binding to recombinant human gamma-aminobutyric-acid A receptor alpha5-beta3-gamma2 subtype expressed in L (tk-) cells				J Med Chem 48: 1367-83 (2005) Article DOI: 10.1021/jm040883v BindingDB Entry DOI: 10.7270/Q2ZW1KD2
					More data for this Ligand-Target Pair
GABA receptor alpha-3/beta-3/gamma-2 subunit (Homo sapiens (Human))	BDBM50162188 (5-methyl-1,3-thiazol-4-yl[6-phenyl-4,5,7,8-tetraaz...) Show SMILES Cc1scnc1COc1nn2c(nnc2c2C3CCC(CC3)c12)-c1ccccc1 |(-2.26,-4.74,;-.79,-5.23,;-.32,-6.68,;1.22,-6.68,;1.71,-5.23,;.45,-4.32,;.45,-2.76,;-.88,-2.01,;-.88,-.47,;.45,.3,;.45,1.84,;1.62,2.91,;.96,4.26,;-.55,4.12,;-.88,2.61,;-2.21,1.84,;-3.56,2.51,;-4.87,1.84,;-4.87,.3,;-3.54,-.47,;-4.47,1.07,;-2.91,1.07,;-2.21,.3,;3.11,2.59,;3.6,1.16,;5.12,.86,;6.12,2.01,;5.63,3.47,;4.11,3.77,)| Show InChI InChI=1S/C22H21N5OS/c1-13-17(23-12-29-13)11-28-22-19-15-9-7-14(8-10-15)18(19)21-25-24-20(27(21)26-22)16-5-3-2-4-6-16/h2-6,12,14-15H,7-11H2,1H3	PDB UniProtKB/SwissProt antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	12	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Merck Sharp & Dohme Research Laboratories Curated by ChEMBL					Assay Description Inhibition of [3H]-Ro-15-1788 binding to recombinant human gamma-aminobutyric-acid A receptor alpha3-beta3-gamma2 subtype expressed in L (tk-) cells				J Med Chem 48: 1367-83 (2005) Article DOI: 10.1021/jm040883v BindingDB Entry DOI: 10.7270/Q2ZW1KD2
					More data for this Ligand-Target Pair
GABA receptor alpha-2/beta-3/gamma-2 subunit (Homo sapiens (Human))	BDBM50162188 (5-methyl-1,3-thiazol-4-yl[6-phenyl-4,5,7,8-tetraaz...) Show SMILES Cc1scnc1COc1nn2c(nnc2c2C3CCC(CC3)c12)-c1ccccc1 |(-2.26,-4.74,;-.79,-5.23,;-.32,-6.68,;1.22,-6.68,;1.71,-5.23,;.45,-4.32,;.45,-2.76,;-.88,-2.01,;-.88,-.47,;.45,.3,;.45,1.84,;1.62,2.91,;.96,4.26,;-.55,4.12,;-.88,2.61,;-2.21,1.84,;-3.56,2.51,;-4.87,1.84,;-4.87,.3,;-3.54,-.47,;-4.47,1.07,;-2.91,1.07,;-2.21,.3,;3.11,2.59,;3.6,1.16,;5.12,.86,;6.12,2.01,;5.63,3.47,;4.11,3.77,)| Show InChI InChI=1S/C22H21N5OS/c1-13-17(23-12-29-13)11-28-22-19-15-9-7-14(8-10-15)18(19)21-25-24-20(27(21)26-22)16-5-3-2-4-6-16/h2-6,12,14-15H,7-11H2,1H3	PDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	21	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Merck Sharp & Dohme Research Laboratories Curated by ChEMBL					Assay Description Inhibition of [3H]-Ro-15-1788 binding to recombinant human gamma-aminobutyric acid A receptor alpha2-beta3-gamma2 subtype expressed in L (tk-) cells				J Med Chem 48: 1367-83 (2005) Article DOI: 10.1021/jm040883v BindingDB Entry DOI: 10.7270/Q2ZW1KD2
					More data for this Ligand-Target Pair
GABA receptor alpha-1/beta-3/gamma-2 subunit (Homo sapiens (Human))	BDBM50162188 (5-methyl-1,3-thiazol-4-yl[6-phenyl-4,5,7,8-tetraaz...) Show SMILES Cc1scnc1COc1nn2c(nnc2c2C3CCC(CC3)c12)-c1ccccc1 |(-2.26,-4.74,;-.79,-5.23,;-.32,-6.68,;1.22,-6.68,;1.71,-5.23,;.45,-4.32,;.45,-2.76,;-.88,-2.01,;-.88,-.47,;.45,.3,;.45,1.84,;1.62,2.91,;.96,4.26,;-.55,4.12,;-.88,2.61,;-2.21,1.84,;-3.56,2.51,;-4.87,1.84,;-4.87,.3,;-3.54,-.47,;-4.47,1.07,;-2.91,1.07,;-2.21,.3,;3.11,2.59,;3.6,1.16,;5.12,.86,;6.12,2.01,;5.63,3.47,;4.11,3.77,)| Show InChI InChI=1S/C22H21N5OS/c1-13-17(23-12-29-13)11-28-22-19-15-9-7-14(8-10-15)18(19)21-25-24-20(27(21)26-22)16-5-3-2-4-6-16/h2-6,12,14-15H,7-11H2,1H3	PDB UniProtKB/SwissProt antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	35	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Merck Sharp & Dohme Research Laboratories Curated by ChEMBL					Assay Description Inhibition of [3H]-Ro-15-1788 binding to recombinant human gamma-aminobutyric-acid A receptor alpha1-beta3-gamma2 subtype expressed in L (tk-) cells				J Med Chem 48: 1367-83 (2005) Article DOI: 10.1021/jm040883v BindingDB Entry DOI: 10.7270/Q2ZW1KD2
					More data for this Ligand-Target Pair