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BDBM50183123 CHEMBL208178::N-(2-(trifluoromethyl)benzyl)-N-(3-methoxypropyl)piperidin-4-amine tartaric acid salt

SMILES: COCCCN(Cc1ccccc1C(F)(F)F)C1CCNCC1

InChI Key: InChIKey=CLDXJLMEWNXPIV-UHFFFAOYSA-N

Data: 2 KI

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50183123   
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))
BDBM50183123
PNG
(CHEMBL208178 | N-(2-(trifluoromethyl)benzyl)-N-(3-...)
Show SMILES COCCCN(Cc1ccccc1C(F)(F)F)C1CCNCC1
Show InChI InChI=1S/C17H25F3N2O/c1-23-12-4-11-22(15-7-9-21-10-8-15)13-14-5-2-3-6-16(14)17(18,19)20/h2-3,5-6,15,21H,4,7-13H2,1H3
PDB

KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
2.20n/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))
BDBM50183123
PNG
(CHEMBL208178 | N-(2-(trifluoromethyl)benzyl)-N-(3-...)
Show SMILES COCCCN(Cc1ccccc1C(F)(F)F)C1CCNCC1
Show InChI InChI=1S/C17H25F3N2O/c1-23-12-4-11-22(15-7-9-21-10-8-15)13-14-5-2-3-6-16(14)17(18,19)20/h2-3,5-6,15,21H,4,7-13H2,1H3
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
6.80n/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