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BDBM50294278 CHEMBL563404::rac2-((biphenyl-2-yloxy)(piperidin-4-yl)methyl)pyridine

SMILES: C1CC(CCN1)C(Oc1ccccc1-c1ccccc1)c1ccccn1

InChI Key: InChIKey=GNYXJFDSZWNBKT-UHFFFAOYSA-N

Data: 2 IC50

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 = 50294278   
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))
BDBM50294278
PNG
(CHEMBL563404 | rac2-((biphenyl-2-yloxy)(piperidin-...)
Show SMILES C1CC(CCN1)C(Oc1ccccc1-c1ccccc1)c1ccccn1
Show InChI InChI=1S/C23H24N2O/c1-2-8-18(9-3-1)20-10-4-5-12-22(20)26-23(19-13-16-24-17-14-19)21-11-6-7-15-25-21/h1-12,15,19,23-24H,13-14,16-17H2
PDB

KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a>400n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of [3H]5-HT uptake at human 5HTT expressed in HEK293 cells


Bioorg Med Chem Lett 19: 2829-34 (2009)


Article DOI: 10.1016/j.bmcl.2009.03.090
BindingDB Entry DOI: 10.7270/Q2HX1CQX
More data for this
Ligand-Target Pair
Sodium-dependent noradrenaline transporter


(Homo sapiens (Human))
BDBM50294278
PNG
(CHEMBL563404 | rac2-((biphenyl-2-yloxy)(piperidin-...)
Show SMILES C1CC(CCN1)C(Oc1ccccc1-c1ccccc1)c1ccccn1
Show InChI InChI=1S/C23H24N2O/c1-2-8-18(9-3-1)20-10-4-5-12-22(20)26-23(19-13-16-24-17-14-19)21-11-6-7-15-25-21/h1-12,15,19,23-24H,13-14,16-17H2
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 33n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of [3H]NA uptake at human NET expressed in HEK293 cells


Bioorg Med Chem Lett 19: 2829-34 (2009)


Article DOI: 10.1016/j.bmcl.2009.03.090
BindingDB Entry DOI: 10.7270/Q2HX1CQX
More data for this
Ligand-Target Pair