BDBM50161385 1-Ethyl-3-{3-[(R)-2-(4-phenyl-butyl)-2,3-dihydro-benzofuran-4-yl]-propyl}-urea::CHEMBL181192

SMILES CCNC(=O)NCCCc1cccc2O[C@H](CCCCc3ccccc3)Cc12

InChI Key InChIKey=NOXXWORJBNFRNY-UHFFFAOYSA-N

Data  2 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 2 hits for monomerid = 50161385   

TargetMelatonin receptor type 1A(Human)
Bristol-Myers Squibb Pharmaceutical Research Institute

Curated by ChEMBL
LigandPNGBDBM50161385(1-Ethyl-3-{3-[(R)-2-(4-phenyl-butyl)-2,3-dihydro-b...)
Affinity DataKi:  9nMAssay Description:Binding affinity against Melatonin receptor type 1A stably expressed in NIH3T3 cells using 2-[125I]iodomelatoninMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetMelatonin receptor type 1B(Human)
Bristol-Myers Squibb Pharmaceutical Research Institute

Curated by ChEMBL
LigandPNGBDBM50161385(1-Ethyl-3-{3-[(R)-2-(4-phenyl-butyl)-2,3-dihydro-b...)
Affinity DataKi:  40nMAssay Description:Binding affinity against Melatonin receptor type 1B stably expressed in NIH3T3 cells using 2-[125I]iodomelatoninMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed