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BDBM50126808 3-Benzyl-8-(4-chloro-phenyl)-3-aza-bicyclo[3.2.1]octane::CHEMBL35334

SMILES: Clc1ccc(cc1)C1C2CCC1CN(Cc1ccccc1)C2

InChI Key: InChIKey=OIXPCGHWOPKIGQ-UHFFFAOYSA-N

Data: 3 IC50

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   Substructure
Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50126808   
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 dopamine transporter


(Rattus norvegicus (rat))
BDBM50126808
PNG
(3-Benzyl-8-(4-chloro-phenyl)-3-aza-bicyclo[3.2.1]o...)
Show SMILES Clc1ccc(cc1)C1C2CCC1CN(Cc1ccccc1)C2 |THB:4:7:13.21.12:9.10,14:13:7:9.10|
Show InChI InChI=1S/C20H22ClN/c21-19-10-8-16(9-11-19)20-17-6-7-18(20)14-22(13-17)12-15-4-2-1-3-5-15/h1-5,8-11,17-18,20H,6-7,12-14H2
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KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 95.5n/an/an/an/an/an/a



School of Chemistry and Biochemistry

Curated by ChEMBL


Assay Description
Inhibition of [3H]WIN-35428 binding to the cocaine binding site on the dopamine transporter (DAT) in synaptosomal membrane preparations from rat stri...


J Med Chem 46: 1456-64 (2003)


Article DOI: 10.1021/jm020410t
BindingDB Entry DOI: 10.7270/Q2W096PJ
More data for this
Ligand-Target Pair
Sodium-dependent dopamine transporter


(Rattus norvegicus (rat))
BDBM50126808
PNG
(3-Benzyl-8-(4-chloro-phenyl)-3-aza-bicyclo[3.2.1]o...)
Show SMILES Clc1ccc(cc1)C1C2CCC1CN(Cc1ccccc1)C2 |THB:4:7:13.21.12:9.10,14:13:7:9.10|
Show InChI InChI=1S/C20H22ClN/c21-19-10-8-16(9-11-19)20-17-6-7-18(20)14-22(13-17)12-15-4-2-1-3-5-15/h1-5,8-11,17-18,20H,6-7,12-14H2
Reactome pathway
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 601n/an/an/an/an/an/a



School of Chemistry and Biochemistry

Curated by ChEMBL


Assay Description
Inhibition of [3H]DA binding to DAT in rat striatal synaptosomes.


J Med Chem 46: 1456-64 (2003)


Article DOI: 10.1021/jm020410t
BindingDB Entry DOI: 10.7270/Q2W096PJ
More data for this
Ligand-Target Pair
Sodium-dependent serotonin transporter


(Rattus norvegicus (rat))
BDBM50126808
PNG
(3-Benzyl-8-(4-chloro-phenyl)-3-aza-bicyclo[3.2.1]o...)
Show SMILES Clc1ccc(cc1)C1C2CCC1CN(Cc1ccccc1)C2 |THB:4:7:13.21.12:9.10,14:13:7:9.10|
Show InChI InChI=1S/C20H22ClN/c21-19-10-8-16(9-11-19)20-17-6-7-18(20)14-22(13-17)12-15-4-2-1-3-5-15/h1-5,8-11,17-18,20H,6-7,12-14H2
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 402n/an/an/an/an/an/a



School of Chemistry and Biochemistry

Curated by ChEMBL


Assay Description
Inhibition of [3H]citalopram binding to Serotonin transporter (5-HTT) in rat cortical tissue.


J Med Chem 46: 1456-64 (2003)


Article DOI: 10.1021/jm020410t
BindingDB Entry DOI: 10.7270/Q2W096PJ
More data for this
Ligand-Target Pair