BDBM50136406 CHEMBL138744::N-[(S)-1-(2,3-Dihydro-benzofuran-4-yl)-pyrrolidin-3-yl]-isobutyramide

SMILES CC(C)C(=O)N[C@H]1CCN(C1)c1cccc2OCCc12

InChI Key InChIKey=MRHCVLSMVRDSOU-UHFFFAOYSA-N

Data  2 KI

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

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50136406   

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

Curated by ChEMBL
LigandPNGBDBM50136406(N-[(S)-1-(2,3-Dihydro-benzofuran-4-yl)-pyrrolidin-...)
Affinity DataKi:  6nMAssay Description:Binding affinity against human MT1 melatonin receptor expressed in NIH3T3 cells.More 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
LigandPNGBDBM50136406(N-[(S)-1-(2,3-Dihydro-benzofuran-4-yl)-pyrrolidin-...)
Affinity DataKi:  6.40nMAssay Description:Binding affinity against human MT2 melatonin receptor expressed in NIH3T3 cellsMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed