BDBM50346309 CHEMBL1782580::cis-((1S,3R)-3-((3S,4S)-3-hydroxytetrahydro-2H-pyran-4-ylamino)-1-isopropylcyclopentyl)(4-(4-(trifluoromethyl)pyridin-2-yl)piperazin-1-yl)methanone

SMILES CC(C)[C@@]1(CC[C@H](C1)N[C@H]1CCOC[C@H]1O)C(=O)N1CCN(CC1)c1cc(ccn1)C(F)(F)F

InChI Key InChIKey=PZWALEZJXWWGIX-UHFFFAOYSA-N

Data  3 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50346309   

LigandPNGBDBM50346309(cis-((1S,3R)-3-((3S,4S)-3-hydroxytetrahydro-2H-pyr...)
Affinity DataIC50: 300nMAssay Description:Displacement of labeled dofetilide from human ERGMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/6/2011
Entry Details Article
PubMed
TargetC-C chemokine receptor type 2(Human)
Pfizer

Curated by ChEMBL
LigandPNGBDBM50346309(cis-((1S,3R)-3-((3S,4S)-3-hydroxytetrahydro-2H-pyr...)
Affinity DataIC50: 15.4nMAssay Description:Displacement of [125I]MCP1 from human CCR2 preincubated for 30 mins by human whole cell binding assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/6/2011
Entry Details Article
PubMed
TargetC-C chemokine receptor type 2(Human)
Pfizer

Curated by ChEMBL
LigandPNGBDBM50346309(cis-((1S,3R)-3-((3S,4S)-3-hydroxytetrahydro-2H-pyr...)
Affinity DataIC50: 710nMAssay Description:Antagonist activity at human CCR2 by whole blood assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/6/2011
Entry Details Article
PubMed