BDBM50161379 1-{(1R,2R)-2-[(R)-5-Chloro-2-(4-phenyl-butyl)-2,3-dihydro-benzofuran-4-yl]-cyclopropylmethyl}-3-ethyl-urea::CHEMBL181457

SMILES CCNC(=O)NC[C@@H]1C[C@H]1c1c2C[C@@H](CCCCc3ccccc3)Oc2ccc1Cl

InChI Key InChIKey=PYZDDNCOVWNABU-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 = 50161379   

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

Curated by ChEMBL
LigandPNGBDBM50161379(1-{(1R,2R)-2-[(R)-5-Chloro-2-(4-phenyl-butyl)-2,3-...)
Affinity DataKi:  60nMAssay 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
LigandPNGBDBM50161379(1-{(1R,2R)-2-[(R)-5-Chloro-2-(4-phenyl-butyl)-2,3-...)
Affinity DataKi:  90nMAssay 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