BDBM50110089 4N-ethyl-4N-[benzyloxycarbonyl]-1-[5'-phenyl-(3a'S,4'S,5'S)-spiro[cyclohexane-1,2'-perhydropyrrolo[1,2-b]isoxazole]-4-ylmethyl]hexahydro-4-pyridinamine::CHEMBL161480::benzyl ethyl(1-(((3a'S,4'S,5'S)-5'-phenyltetrahydro-3'H-spiro[cyclohexane-1,2'-pyrrolo[1,2-b]isoxazole]-4'-yl)methyl)piperidin-4-yl)carbamate

SMILES CCN(C1CCN(C[C@H]2[C@@H]3CC4(CCCCC4)ON3C[C@@H]2c2ccccc2)CC1)C(=O)OCc1ccccc1

InChI Key InChIKey=ZTKPOMSHWQYZEG-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 = 50110089   

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

Curated by ChEMBL
LigandPNGBDBM50110089(benzyl ethyl(1-(((3a'S,4'S,5'S)-5'-phenyltetrahydr...)
Affinity DataIC50: 86nMAssay 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
LigandPNGBDBM50110089(benzyl ethyl(1-(((3a'S,4'S,5'S)-5'-phenyltetrahydr...)
Affinity DataIC50: 86nMAssay 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