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BDBM50492437 CHEMBL2402554

SMILES: Cl.CN1CC(C1)(OCc1ccccc1)c1ccc(Cl)c(Cl)c1

InChI Key: InChIKey=DLCBNSFEKFJPNX-UHFFFAOYSA-N

Data: 2 KI

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 = 50492437   
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


(Rattus norvegicus (rat))
BDBM50492437
PNG
(CHEMBL2402554)
Show SMILES Cl.CN1CC(C1)(OCc1ccccc1)c1ccc(Cl)c(Cl)c1
Show InChI InChI=1S/C17H17Cl2NO/c1-20-11-17(12-20,14-7-8-15(18)16(19)9-14)21-10-13-5-3-2-4-6-13/h2-9H,10-12H2,1H3
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
23n/an/an/an/an/an/an/an/a



University of New Orleans

Curated by ChEMBL


Assay Description
Displacement of [3H]Citalopram from SERT in Sprague-Dawley rat brain homogenate after 60 mins by scintillation counting analysis


Bioorg Med Chem Lett 23: 4404-7 (2013)


Article DOI: 10.1016/j.bmcl.2013.05.071
BindingDB Entry DOI: 10.7270/Q2DN47ZV
More data for this
Ligand-Target Pair
Sodium-dependent dopamine transporter


(Rattus norvegicus (rat))
BDBM50492437
PNG
(CHEMBL2402554)
Show SMILES Cl.CN1CC(C1)(OCc1ccccc1)c1ccc(Cl)c(Cl)c1
Show InChI InChI=1S/C17H17Cl2NO/c1-20-11-17(12-20,14-7-8-15(18)16(19)9-14)21-10-13-5-3-2-4-6-13/h2-9H,10-12H2,1H3
Reactome pathway
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
620n/an/an/an/an/an/an/an/a



University of New Orleans

Curated by ChEMBL


Assay Description
Displacement of [3H]WIN 35,428 from DAT in Sprague-Dawley rat brain homogenate preincubated for 5 mins prior to radioligand addition measured after 1...


Bioorg Med Chem Lett 23: 4404-7 (2013)


Article DOI: 10.1016/j.bmcl.2013.05.071
BindingDB Entry DOI: 10.7270/Q2DN47ZV
More data for this
Ligand-Target Pair