BDBM50161378 CHEMBL367604::N-{(1R,2R)-2-[(R)-2-(4-Phenyl-butyl)-2,3-dihydro-benzofuran-4-yl]-cyclopropylmethyl}-butyramide

SMILES CCCC(=O)NC[C@@H]1C[C@H]1c1cccc2O[C@H](CCCCc3ccccc3)Cc12

InChI Key InChIKey=SPGQTSFBVUOAFP-UHFFFAOYSA-N

Data  2 KI

  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 2 hits for monomerid = 50161378   

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

Curated by ChEMBL
LigandPNGBDBM50161378(N-{(1R,2R)-2-[(R)-2-(4-Phenyl-butyl)-2,3-dihydro-b...)
Affinity DataKi:  2nMAssay 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
TargetMelatonin receptor type 1A(Human)
Bristol-Myers Squibb Pharmaceutical Research Institute

Curated by ChEMBL
LigandPNGBDBM50161378(N-{(1R,2R)-2-[(R)-2-(4-Phenyl-butyl)-2,3-dihydro-b...)
Affinity DataKi:  2nMAssay 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