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BDBM50188061 2-(2-phenyl-2-(piperazin-1-yl)ethyl)benzamide::CHEMBL209969

SMILES: NC(=O)c1ccccc1CC(N1CCNCC1)c1ccccc1

InChI Key: InChIKey=MGQYROXWDORYIL-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 = 50188061   
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))
BDBM50188061
PNG
(2-(2-phenyl-2-(piperazin-1-yl)ethyl)benzamide | CH...)
Show SMILES NC(=O)c1ccccc1CC(N1CCNCC1)c1ccccc1
Show InChI InChI=1S/C19H23N3O/c20-19(23)17-9-5-4-8-16(17)14-18(15-6-2-1-3-7-15)22-12-10-21-11-13-22/h1-9,18,21H,10-14H2,(H2,20,23)
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 5HT transporter expressed in HEK293 cells


Bioorg Med Chem Lett 16: 4345-8 (2006)


Article DOI: 10.1016/j.bmcl.2006.05.051
BindingDB Entry DOI: 10.7270/Q2H99608
More data for this
Ligand-Target Pair
Sodium-dependent noradrenaline transporter


(Homo sapiens (Human))
BDBM50188061
PNG
(2-(2-phenyl-2-(piperazin-1-yl)ethyl)benzamide | CH...)
Show SMILES NC(=O)c1ccccc1CC(N1CCNCC1)c1ccccc1
Show InChI InChI=1S/C19H23N3O/c20-19(23)17-9-5-4-8-16(17)14-18(15-6-2-1-3-7-15)22-12-10-21-11-13-22/h1-9,18,21H,10-14H2,(H2,20,23)
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

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]NA uptake at NA transporter expressed in HEK293 cells


Bioorg Med Chem Lett 16: 4345-8 (2006)


Article DOI: 10.1016/j.bmcl.2006.05.051
BindingDB Entry DOI: 10.7270/Q2H99608
More data for this
Ligand-Target Pair