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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Sodium-dependent serotonin transporter' and Ligand = 'BDBM50371829'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Sodium-dependent serotonin transporter


(Homo sapiens (Human))
BDBM50371829
PNG
(CHEMBL258338)
Show SMILES CO[C@]1(CCCC[C@H]1CN(C)C)c1ccccc1
Show InChI InChI=1S/C16H25NO/c1-17(2)13-15-11-7-8-12-16(15,18-3)14-9-5-4-6-10-14/h4-6,9-10,15H,7-8,11-13H2,1-3H3/t15-,16+/m0/s1
PDB

KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 3.88E+3n/an/an/an/an/an/a



Sepracor Inc.

Curated by ChEMBL


Assay Description
Inhibition of SERT mediated 5-hydroxytryptamine uptake


Bioorg Med Chem Lett 18: 1674-80 (2008)


Article DOI: 10.1016/j.bmcl.2008.01.051
BindingDB Entry DOI: 10.7270/Q2VQ33HQ
More data for this
Ligand-Target Pair