BDBM50110100 CHEMBL158438::[1-((2S,3aS,4S,5S)-2,5-Diphenyl-hexahydro-pyrrolo[1,2-b]isoxazol-4-ylmethyl)-piperidin-4-yl]-ethyl-carbamic acid benzyl ester::benzyl 1-(((2S,3aS,4S,5S)-2,5-diphenylhexahydropyrrolo[1,2-b]isoxazol-4-yl)methyl)piperidin-4-yl(ethyl)carbamate

SMILES CCN(C1CCN(C[C@H]2[C@@H]3C[C@H](ON3C[C@@H]2c2ccccc2)c2ccccc2)CC1)C(=O)OCc1ccccc1

InChI Key InChIKey=WIIDGEGJDZSGHC-UHFFFAOYSA-N

Data  2 IC50

  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 = 50110100   

TargetC-C chemokine receptor type 5(Human)
Merck Research Laboratories

Curated by ChEMBL
LigandPNGBDBM50110100(benzyl 1-(((2S,3aS,4S,5S)-2,5-diphenylhexahydropyr...)
Affinity DataIC50: 46nMAssay Description:Ability to displace [125I]-labeled MIP-1alpha from the C-C chemokine receptor type 5 expressed on CHO cell membranesMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetC-C chemokine receptor type 5(Human)
Merck Research Laboratories

Curated by ChEMBL
LigandPNGBDBM50110100(benzyl 1-(((2S,3aS,4S,5S)-2,5-diphenylhexahydropyr...)
Affinity DataIC50: 46nMAssay Description:Displacement of [125I]MIP1alpha from human CCR5 expressed in CHO cellsMore data for this Ligand-Target Pair
In Depth
Date in BDB:
1/11/2010
Entry Details Article
PubMed