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BDBM50183142 2-((4-fluoro-2-(trifluoromethyl)benzyl)(piperidin-4-yl)amino)ethanol fumaric acid salt::CHEMBL207635

SMILES: OCCN(Cc1ccc(F)cc1C(F)(F)F)C1CCNCC1

InChI Key: InChIKey=TUZIEBVNHAQAJS-UHFFFAOYSA-N

Data: 2 KI

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
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Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50183142   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Sodium-dependent serotonin transporter


(Homo sapiens (Human))
BDBM50183142
PNG
(2-((4-fluoro-2-(trifluoromethyl)benzyl)(piperidin-...)
Show SMILES OCCN(Cc1ccc(F)cc1C(F)(F)F)C1CCNCC1
Show InChI InChI=1S/C15H20F4N2O/c16-12-2-1-11(14(9-12)15(17,18)19)10-21(7-8-22)13-3-5-20-6-4-13/h1-2,9,13,20,22H,3-8,10H2
PDB

KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
3.10n/an/an/an/an/an/an/an/a



Eli Lilly and Company

Curated by ChEMBL


Assay Description
Displacement of [3H]citalopram from SERT


Bioorg Med Chem Lett 16: 2714-8 (2006)


Article DOI: 10.1016/j.bmcl.2006.02.008
BindingDB Entry DOI: 10.7270/Q2SF2VR6
More data for this
Ligand-Target Pair
Sodium-dependent noradrenaline transporter


(Homo sapiens (Human))
BDBM50183142
PNG
(2-((4-fluoro-2-(trifluoromethyl)benzyl)(piperidin-...)
Show SMILES OCCN(Cc1ccc(F)cc1C(F)(F)F)C1CCNCC1
Show InChI InChI=1S/C15H20F4N2O/c16-12-2-1-11(14(9-12)15(17,18)19)10-21(7-8-22)13-3-5-20-6-4-13/h1-2,9,13,20,22H,3-8,10H2
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
96n/an/an/an/an/an/an/an/a



Eli Lilly and Company

Curated by ChEMBL


Assay Description
Displacement of [3H]nisoxetine from NET


Bioorg Med Chem Lett 16: 2714-8 (2006)


Article DOI: 10.1016/j.bmcl.2006.02.008
BindingDB Entry DOI: 10.7270/Q2SF2VR6
More data for this
Ligand-Target Pair