BDBM50314677 (5-methyl-2-(2H-1,2,3-triazol-2-yl)phenyl)(6-(quinazolin-2-yl)-3,6-diazabicyclo[3.2.1]octan-3-yl)methanone::CHEMBL1091110

SMILES Cc1ccc(c(c1)C(=O)N1CC2CC(C1)N(C2)c1ncc2ccccc2n1)-n1nccn1

InChI Key InChIKey=DAHCXLGKBDYGNR-UHFFFAOYSA-N

Data  6 KI  6 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
   Substructure
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Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 12 hits for monomerid = 50314677   

TargetOrexin/Hypocretin receptor type 1(Homo sapiens (Human))
Merck Research Laboratories

Curated by ChEMBL
LigandPNGBDBM50314677((5-methyl-2-(2H-1,2,3-triazol-2-yl)phenyl)(6-(quin...)
Affinity DataKi:  2.30nMAssay Description:Binding affinity to OX1 receptor by radioligand displacement assayMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetOrexin/Hypocretin receptor type 1(Homo sapiens (Human))
Merck Research Laboratories

Curated by ChEMBL
LigandPNGBDBM50314677((5-methyl-2-(2H-1,2,3-triazol-2-yl)phenyl)(6-(quin...)
Affinity DataKi:  2.30nMAssay Description:Binding affinity to OX1 receptor by radioligand displacement assayMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetOrexin receptor type 2(Homo sapiens (Human))
Merck Research Laboratories

Curated by ChEMBL
LigandPNGBDBM50314677((5-methyl-2-(2H-1,2,3-triazol-2-yl)phenyl)(6-(quin...)
Affinity DataKi:  3.60nMAssay Description:Binding affinity to OX2 receptor by radioligand displacement assayMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetOrexin receptor type 2(Homo sapiens (Human))
Merck Research Laboratories

Curated by ChEMBL
LigandPNGBDBM50314677((5-methyl-2-(2H-1,2,3-triazol-2-yl)phenyl)(6-(quin...)
Affinity DataKi:  3.60nMAssay Description:Binding affinity to OX2 receptor by radioligand displacement assayMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetOrexin/Hypocretin receptor type 1(Homo sapiens (Human))
Merck Research Laboratories

Curated by ChEMBL
LigandPNGBDBM50314677((5-methyl-2-(2H-1,2,3-triazol-2-yl)phenyl)(6-(quin...)
Affinity DataKi:  110nMAssay Description:Binding affinity to OX1 receptor by radioligand displacement assayMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetOrexin receptor type 2(Homo sapiens (Human))
Merck Research Laboratories

Curated by ChEMBL
LigandPNGBDBM50314677((5-methyl-2-(2H-1,2,3-triazol-2-yl)phenyl)(6-(quin...)
Affinity DataKi:  155nMAssay Description:Binding affinity to OX2 receptor by radioligand displacement assayMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetOrexin/Hypocretin receptor type 1(Homo sapiens (Human))
Merck Research Laboratories

Curated by ChEMBL
LigandPNGBDBM50314677((5-methyl-2-(2H-1,2,3-triazol-2-yl)phenyl)(6-(quin...)
Affinity DataIC50:  42nMAssay Description:Antagonist activity at OX1 receptor assessed as inhibition of calcium flux by FLIPR assayMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetOrexin/Hypocretin receptor type 1(Homo sapiens (Human))
Merck Research Laboratories

Curated by ChEMBL
LigandPNGBDBM50314677((5-methyl-2-(2H-1,2,3-triazol-2-yl)phenyl)(6-(quin...)
Affinity DataIC50:  42nMAssay Description:Antagonist activity at OX1 receptor assessed as inhibition of calcium flux by FLIPR assayMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetOrexin/Hypocretin receptor type 1(Homo sapiens (Human))
Merck Research Laboratories

Curated by ChEMBL
LigandPNGBDBM50314677((5-methyl-2-(2H-1,2,3-triazol-2-yl)phenyl)(6-(quin...)
Affinity DataIC50:  2.50E+3nMAssay Description:Antagonist activity at OX1 receptor assessed as inhibition of calcium flux by FLIPR assayMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetOrexin receptor type 2(Homo sapiens (Human))
Merck Research Laboratories

Curated by ChEMBL
LigandPNGBDBM50314677((5-methyl-2-(2H-1,2,3-triazol-2-yl)phenyl)(6-(quin...)
Affinity DataIC50:  65nMAssay Description:Antagonist activity at OX2 receptor assessed as inhibition of calcium flux by FLIPR assayMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetOrexin receptor type 2(Homo sapiens (Human))
Merck Research Laboratories

Curated by ChEMBL
LigandPNGBDBM50314677((5-methyl-2-(2H-1,2,3-triazol-2-yl)phenyl)(6-(quin...)
Affinity DataIC50:  65nMAssay Description:Antagonist activity at OX2 receptor assessed as inhibition of calcium flux by FLIPR assayMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetOrexin receptor type 2(Homo sapiens (Human))
Merck Research Laboratories

Curated by ChEMBL
LigandPNGBDBM50314677((5-methyl-2-(2H-1,2,3-triazol-2-yl)phenyl)(6-(quin...)
Affinity DataIC50:  6.20E+3nMAssay Description:Antagonist activity at OX2 receptor assessed as inhibition of calcium flux by FLIPR assayMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed