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BDBM50183144 CHEMBL207810::N-(5-fluoro-2-methoxybenzyl)-N-isobutylpiperidin-4-amine fumaric acid salt

SMILES: COc1ccc(F)cc1CN(CC(C)C)C1CCNCC1

InChI Key: InChIKey=OBYWTTLIKLJWKI-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 = 50183144   
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))
BDBM50183144
PNG
(CHEMBL207810 | N-(5-fluoro-2-methoxybenzyl)-N-isob...)
Show SMILES COc1ccc(F)cc1CN(CC(C)C)C1CCNCC1
Show InChI InChI=1S/C17H27FN2O/c1-13(2)11-20(16-6-8-19-9-7-16)12-14-10-15(18)4-5-17(14)21-3/h4-5,10,13,16,19H,6-9,11-12H2,1-3H3
PDB

KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
1.40n/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))
BDBM50183144
PNG
(CHEMBL207810 | N-(5-fluoro-2-methoxybenzyl)-N-isob...)
Show SMILES COc1ccc(F)cc1CN(CC(C)C)C1CCNCC1
Show InChI InChI=1S/C17H27FN2O/c1-13(2)11-20(16-6-8-19-9-7-16)12-14-10-15(18)4-5-17(14)21-3/h4-5,10,13,16,19H,6-9,11-12H2,1-3H3
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
42n/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