BDBM50143117 6-(Pyridin-2-ylmethoxy)-3-vinyl-[1,2,4]triazolo[3,4-a]phthalazine::CHEMBL299802

SMILES: C=Cc1nnc2c3ccccc3c(OCc3ccccn3)nn12

InChI Key: InChIKey=VXDPUKHUSNJVCJ-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 = 50143117   

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))	BDBM50143117 (6-(Pyridin-2-ylmethoxy)-3-vinyl-[1,2,4]triazolo[3,...) Show SMILES C=Cc1nnc2c3ccccc3c(OCc3ccccn3)nn12 Show InChI InChI=1S/C17H13N5O/c1-2-15-19-20-16-13-8-3-4-9-14(13)17(21-22(15)16)23-11-12-7-5-6-10-18-12/h2-10H,1,11H2	PDB KEGG UniProtKB/SwissProt antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	3.20	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Merck Sharp and Dohme Research Laboratories Curated by ChEMBL					Assay Description Binding affinity for human GABA-A receptor alpha5-beta3-gamma2 subunits in L(tk-) cells				J Med Chem 47: 1807-22 (2004) Article DOI: 10.1021/jm031020p BindingDB Entry DOI: 10.7270/Q2959H0R
					More data for this Ligand-Target Pair
GABA receptor alpha-3/beta-3/gamma-2 subunit (Homo sapiens (Human))	BDBM50143117 (6-(Pyridin-2-ylmethoxy)-3-vinyl-[1,2,4]triazolo[3,...) Show SMILES C=Cc1nnc2c3ccccc3c(OCc3ccccn3)nn12 Show InChI InChI=1S/C17H13N5O/c1-2-15-19-20-16-13-8-3-4-9-14(13)17(21-22(15)16)23-11-12-7-5-6-10-18-12/h2-10H,1,11H2	PDB UniProtKB/SwissProt antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	11	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Merck Sharp and Dohme Research Laboratories Curated by ChEMBL					Assay Description Binding affinity for human GABA-A receptor alpha3-beta3-gamma2 subunits in L(tk-) cells				J Med Chem 47: 1807-22 (2004) Article DOI: 10.1021/jm031020p BindingDB Entry DOI: 10.7270/Q2959H0R
					More data for this Ligand-Target Pair
GABA receptor alpha-2/beta-3/gamma-2 subunit (Homo sapiens (Human))	BDBM50143117 (6-(Pyridin-2-ylmethoxy)-3-vinyl-[1,2,4]triazolo[3,...) Show SMILES C=Cc1nnc2c3ccccc3c(OCc3ccccn3)nn12 Show InChI InChI=1S/C17H13N5O/c1-2-15-19-20-16-13-8-3-4-9-14(13)17(21-22(15)16)23-11-12-7-5-6-10-18-12/h2-10H,1,11H2	PDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	28	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Merck Sharp and Dohme Research Laboratories Curated by ChEMBL					Assay Description Binding affinity for human GABA-A receptor alpha2-beta3-gamma2 subunits in L(tk-) cells				J Med Chem 47: 1807-22 (2004) Article DOI: 10.1021/jm031020p BindingDB Entry DOI: 10.7270/Q2959H0R
					More data for this Ligand-Target Pair
GABA receptor alpha-1/beta-3/gamma-2 subunit (Homo sapiens (Human))	BDBM50143117 (6-(Pyridin-2-ylmethoxy)-3-vinyl-[1,2,4]triazolo[3,...) Show SMILES C=Cc1nnc2c3ccccc3c(OCc3ccccn3)nn12 Show InChI InChI=1S/C17H13N5O/c1-2-15-19-20-16-13-8-3-4-9-14(13)17(21-22(15)16)23-11-12-7-5-6-10-18-12/h2-10H,1,11H2	PDB UniProtKB/SwissProt antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	49	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Merck Sharp and Dohme Research Laboratories Curated by ChEMBL					Assay Description Binding affinity for human GABA-A receptor alpha4-beta3-gamma2 subunits in L(tk-) cells				J Med Chem 47: 1807-22 (2004) Article DOI: 10.1021/jm031020p BindingDB Entry DOI: 10.7270/Q2959H0R
					More data for this Ligand-Target Pair