BDBM50108619 CHEMBL3597954

SMILES Cc1nc(C(=O)N2CCC[C@@H](COc3ccc(F)cc3)C2)c(s1)-c1ccccc1

InChI Key InChIKey=XDICDRGPXZPGOR-QGZVFWFLSA-N

Data  4 KI

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 50108619   

TargetOrexin/Hypocretin receptor type 1(Homo sapiens (Human))
Actelion Pharmaceuticals

Curated by ChEMBL
LigandPNGBDBM50108619(CHEMBL3597954)
Affinity DataKi:  23nMAssay Description:Antagonist activity at orexin-1 receptor (unknown origin)More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetOrexin/Hypocretin receptor type 1(Homo sapiens (Human))
Actelion Pharmaceuticals

Curated by ChEMBL
LigandPNGBDBM50108619(CHEMBL3597954)
Affinity DataKi:  23nMAssay Description:Binding affinity to OX1R (unknown origin)More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetOrexin receptor type 2(Homo sapiens (Human))
Merck Research Laboratories

Curated by ChEMBL
LigandPNGBDBM50108619(CHEMBL3597954)
Affinity DataKi:  44nMAssay Description:Binding affinity to OX2R (unknown origin)More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetOrexin receptor type 2(Homo sapiens (Human))
Merck Research Laboratories

Curated by ChEMBL
LigandPNGBDBM50108619(CHEMBL3597954)
Affinity DataKi:  44nMAssay Description:Antagonist activity at orexin-2 receptor (unknown origin)More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed