BindingDB logo
myBDB logout
Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Sodium-dependent serotonin transporter' and Ligand = 'BDBM50313260'   
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))
BDBM50313260
PNG
(CHEMBL1086613 | N-(3-(4-(2,3-Dimethylphenyl)pipera...)
Show SMILES CCn1c(C)c(cc1-c1ccccc1)C(=O)NCCCN1CCN(CC1)c1cccc(C)c1C
Show InChI InChI=1S/C29H38N4O/c1-5-33-24(4)26(21-28(33)25-12-7-6-8-13-25)29(34)30-15-10-16-31-17-19-32(20-18-31)27-14-9-11-22(2)23(27)3/h6-9,11-14,21H,5,10,15-20H2,1-4H3,(H,30,34)
PDB

KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/a 35.9n/an/an/an/an/an/a



Green Cross Corporation

Curated by ChEMBL


Assay Description
Displacement of [3H]imipramine from human SERT expressed in HEK293 cells after 30 mins by rapid filtration assay


Bioorg Med Chem Lett 20: 1705-11 (2010)


Article DOI: 10.1016/j.bmcl.2010.01.093
BindingDB Entry DOI: 10.7270/Q2SN093C
More data for this
Ligand-Target Pair
Sodium-dependent serotonin transporter


(Homo sapiens (Human))
BDBM50313260
PNG
(CHEMBL1086613 | N-(3-(4-(2,3-Dimethylphenyl)pipera...)
Show SMILES CCn1c(C)c(cc1-c1ccccc1)C(=O)NCCCN1CCN(CC1)c1cccc(C)c1C
Show InChI InChI=1S/C29H38N4O/c1-5-33-24(4)26(21-28(33)25-12-7-6-8-13-25)29(34)30-15-10-16-31-17-19-32(20-18-31)27-14-9-11-22(2)23(27)3/h6-9,11-14,21H,5,10,15-20H2,1-4H3,(H,30,34)
PDB

KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/a 36n/an/an/an/an/an/a



Green Cross Corporation

Curated by ChEMBL


Assay Description
Displacement of [3H]imipramine from human SERT expressed in HEK293 cells


Bioorg Med Chem 18: 6156-69 (2010)


Article DOI: 10.1016/j.bmc.2010.06.037
BindingDB Entry DOI: 10.7270/Q2W0964C
More data for this
Ligand-Target Pair