BDBM50321513 ((1S,5R)-3-(7-fluoroquinazolin-2-yl)-3,6-diazabicyclo[3.2.2]nonan-6-yl)(5-methyl-2-(2H-1,2,3-triazol-2-yl)phenyl)methanone::CHEMBL1171595

SMILES Cc1ccc(c(c1)C(=O)N1C[C@@H]2CC[C@H]1CN(C2)c1ncc2ccc(F)cc2n1)-n1nccn1

InChI Key

Data  2 KI  2 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 50321513   

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

Curated by ChEMBL
LigandPNGBDBM50321513(((1S,5R)-3-(7-fluoroquinazolin-2-yl)-3,6-diazabicy...)
Affinity DataIC50: 46nMAssay Description:Antagonist activity at OX1R by FLIPR assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/31/2012
Entry Details Article
PubMed
TargetOrexin receptor type 2(Human)
Merck Research Laboratories

Curated by ChEMBL
LigandPNGBDBM50321513(((1S,5R)-3-(7-fluoroquinazolin-2-yl)-3,6-diazabicy...)
Affinity DataIC50: 790nMAssay Description:Antagonist activity at OX2R by FLIPR assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/31/2012
Entry Details Article
PubMed
TargetOrexin/Hypocretin receptor type 1(Human)
Merck Research Laboratories

Curated by ChEMBL
LigandPNGBDBM50321513(((1S,5R)-3-(7-fluoroquinazolin-2-yl)-3,6-diazabicy...)
Affinity DataKi:  2nMAssay Description:Binding affinity to OX1RMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/31/2012
Entry Details Article
PubMed
TargetOrexin receptor type 2(Human)
Merck Research Laboratories

Curated by ChEMBL
LigandPNGBDBM50321513(((1S,5R)-3-(7-fluoroquinazolin-2-yl)-3,6-diazabicy...)
Affinity DataKi:  62nMAssay Description:Binding affinity to OX2RMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/31/2012
Entry Details Article
PubMed