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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 = 'BDBM50473535'   
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


(Rattus norvegicus (rat))
BDBM50473535
PNG
(CHEMBL165467)
Show SMILES [H][C@@]1(CN=CN1)C1C[C@@]11CCc2ccccc2C1 |c:3|
Show InChI InChI=1S/C15H18N2/c1-2-4-12-7-15(6-5-11(12)3-1)8-13(15)14-9-16-10-17-14/h1-4,10,13-14H,5-9H2,(H,16,17)/t13?,14-,15+/m1/s1
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
25n/an/an/an/an/an/an/an/a



Institut de Recherches Servier

Curated by PDSP Ki Database


Assay Description
In vitro binding affinity was determined against serotonin reuptake site of rat in presence of [3H]paroxetine radioligand


J Med Chem 44: 787-805 (2001)


Article DOI: 10.1021/jm001040g
BindingDB Entry DOI: 10.7270/Q2JQ13R9
More data for this
Ligand-Target Pair