BDBM50176775 7-cyclohexyl-6-(2-methyl-2H-1,2,4-triazol-3-yl-methoxy)-3-phenyl-1,2,4-triazolo[4,3-b]pyridazine::CHEMBL224608

SMILES Cn1ncnc1COc1nn2c(nnc2cc1C1CCCCC1)-c1ccccc1

InChI Key InChIKey=YLPHFEFMBAMSKS-UHFFFAOYSA-N

Data  3 KI

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50176775   

TargetGamma-aminobutyric acid receptor subunit alpha-3/beta-3/gamma-2(Human)
Merck Sharp and Dohme Research Laboratories

Curated by ChEMBL
LigandPNGBDBM50176775(7-cyclohexyl-6-(2-methyl-2H-1,2,4-triazol-3-yl-met...)
Affinity DataKi:  4.80nMAssay Description:Displacement of [3H]Ro 15-1788 from human recombinant GABAA alpha-3-beta-3-gamma-2 receptor expressed in L(tk-) cellsMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetGamma-aminobutyric acid receptor subunit alpha-1/beta-3/gamma-2(Human)
Merck Sharp and Dohme Research Laboratories

Curated by ChEMBL
LigandPNGBDBM50176775(7-cyclohexyl-6-(2-methyl-2H-1,2,4-triazol-3-yl-met...)
Affinity DataKi:  6.20nMAssay Description:Displacement of [3H]Ro 15-1788 from human recombinant GABAA alpha-1-beta-3-gamma-2 receptor expressed in L(tk-) cellsMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetGABA-A receptor; alpha-2/beta-3/gamma-2(Human)
Merck Sharp and Dohme Research Laboratories

Curated by ChEMBL
LigandPNGBDBM50176775(7-cyclohexyl-6-(2-methyl-2H-1,2,4-triazol-3-yl-met...)
Affinity DataKi:  14nMAssay Description:Displacement of [3H]Ro 15-1788 from human recombinant GABAA alpha-2-beta-3-gamma-2 receptor expressed in L(tk-) cellsMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed