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BDBM50303315 3-alpha-(4-Dichlorophenyl)methoxy-3-beta-(4-chlorophenyl)-nortropane::CHEMBL566008

SMILES: Clc1ccc(COC2(CC3CCC(C2)N3)c2ccc(Cl)c(Cl)c2)cc1

InChI Key: InChIKey=ZUTKKMGBEIGKKD-UHFFFAOYSA-N

Data: 3 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 3 hits for monomerid = 50303315   
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))
BDBM50303315
PNG
(3-alpha-(4-Dichlorophenyl)methoxy-3-beta-(4-chloro...)
Show SMILES Clc1ccc(COC2(CC3CCC(C2)N3)c2ccc(Cl)c(Cl)c2)cc1 |TLB:6:7:14:10.11,THB:15:7:14:10.11|
Show InChI InChI=1S/C20H20Cl3NO/c21-15-4-1-13(2-5-15)12-25-20(10-16-6-7-17(11-20)24-16)14-3-8-18(22)19(23)9-14/h1-5,8-9,16-17,24H,6-7,10-12H2
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
8.5n/an/an/an/an/an/an/an/a



University of New Orleans

Curated by ChEMBL


Assay Description
Displacement of [3H]citalopram from SERT in rat brain


Bioorg Med Chem Lett 19: 6865-8 (2009)


Article DOI: 10.1016/j.bmcl.2009.10.087
BindingDB Entry DOI: 10.7270/Q24T6K9G
More data for this
Ligand-Target Pair
Sodium-dependent dopamine transporter


(Rattus norvegicus (rat))
BDBM50303315
PNG
(3-alpha-(4-Dichlorophenyl)methoxy-3-beta-(4-chloro...)
Show SMILES Clc1ccc(COC2(CC3CCC(C2)N3)c2ccc(Cl)c(Cl)c2)cc1 |TLB:6:7:14:10.11,THB:15:7:14:10.11|
Show InChI InChI=1S/C20H20Cl3NO/c21-15-4-1-13(2-5-15)12-25-20(10-16-6-7-17(11-20)24-16)14-3-8-18(22)19(23)9-14/h1-5,8-9,16-17,24H,6-7,10-12H2
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UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
390n/an/an/an/an/an/an/an/a



University of New Orleans

Curated by ChEMBL


Assay Description
Displacement of [3H]WIN-35428 from DAT in rat brain


Bioorg Med Chem Lett 19: 6865-8 (2009)


Article DOI: 10.1016/j.bmcl.2009.10.087
BindingDB Entry DOI: 10.7270/Q24T6K9G
More data for this
Ligand-Target Pair
Transporter


(Rattus norvegicus (rat))
BDBM50303315
PNG
(3-alpha-(4-Dichlorophenyl)methoxy-3-beta-(4-chloro...)
Show SMILES Clc1ccc(COC2(CC3CCC(C2)N3)c2ccc(Cl)c(Cl)c2)cc1 |TLB:6:7:14:10.11,THB:15:7:14:10.11|
Show InChI InChI=1S/C20H20Cl3NO/c21-15-4-1-13(2-5-15)12-25-20(10-16-6-7-17(11-20)24-16)14-3-8-18(22)19(23)9-14/h1-5,8-9,16-17,24H,6-7,10-12H2
Reactome pathway

UniProtKB/TrEMBL

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
2.09E+3n/an/an/an/an/an/an/an/a



University of New Orleans

Curated by ChEMBL


Assay Description
Displacement of [3H]nisoxetine from NET in rat brain


Bioorg Med Chem Lett 19: 6865-8 (2009)


Article DOI: 10.1016/j.bmcl.2009.10.087
BindingDB Entry DOI: 10.7270/Q24T6K9G
More data for this
Ligand-Target Pair