BDBM50346307 CHEMBL1782577::cis-((1S,3R)-3-((3S,4S)-3-ethoxytetrahydro-2H-pyran-4-ylamino)-1-isopropylcyclopentyl)(4-(4-(trifluoromethyl)pyridin-2-yl)piperazin-1-yl)methanone

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

InChI Key InChIKey=BFASFNFZHNRMQV-UHFFFAOYSA-N

Data  3 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 3 hits for monomerid = 50346307   

LigandPNGBDBM50346307(cis-((1S,3R)-3-((3S,4S)-3-ethoxytetrahydro-2H-pyra...)
Affinity DataIC50: 8.60E+3nMAssay 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
LigandPNGBDBM50346307(cis-((1S,3R)-3-((3S,4S)-3-ethoxytetrahydro-2H-pyra...)
Affinity DataIC50: 15.5nMAssay 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
LigandPNGBDBM50346307(cis-((1S,3R)-3-((3S,4S)-3-ethoxytetrahydro-2H-pyra...)
Affinity DataIC50: 66.6nMAssay 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