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BDBM50494706 CHEMBL3093268

SMILES: Clc1ccccc1N1CCN(CCc2ccccc2)CC1

InChI Key: InChIKey=GPLJHNLLDGQNDU-UHFFFAOYSA-N

Data: 5 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 5 hits for monomerid = 50494706   
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))
BDBM50494706
PNG
(CHEMBL3093268)
Show SMILES Clc1ccccc1N1CCN(CCc2ccccc2)CC1
Show InChI InChI=1S/C18H21ClN2/c19-17-8-4-5-9-18(17)21-14-12-20(13-15-21)11-10-16-6-2-1-3-7-16/h1-9H,10-15H2
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PC sid
UniChem
Article
PubMed
0.130n/an/an/an/an/an/an/an/a



University of Maryland

Curated by ChEMBL


Assay Description
Displacement of [3H]WIN 35428 from dopamine transporter in rat striatum after 120 mins by liquid scintillation counting analysis


Bioorg Med Chem Lett 23: 6920-6922 (2013)


Article DOI: 10.1016/j.bmcl.2013.09.038
BindingDB Entry DOI: 10.7270/Q2J969B5
More data for this
Ligand-Target Pair
Sigma opioid receptor


(RAT)
BDBM50494706
PNG
(CHEMBL3093268)
Show SMILES Clc1ccccc1N1CCN(CCc2ccccc2)CC1
Show InChI InChI=1S/C18H21ClN2/c19-17-8-4-5-9-18(17)21-14-12-20(13-15-21)11-10-16-6-2-1-3-7-16/h1-9H,10-15H2
PDB

UniProtKB/SwissProt

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PC sid
UniChem
Article
PubMed
0.150n/an/an/an/an/an/an/an/a



University of Maryland

Curated by ChEMBL


Assay Description
Displacement of [3H](+)-pentazocine from sigma1 receptor in rat brain after 120 mins by liquid scintillation counting analysis


Bioorg Med Chem Lett 23: 6920-6922 (2013)


Article DOI: 10.1016/j.bmcl.2013.09.038
BindingDB Entry DOI: 10.7270/Q2J969B5
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Rattus norvegicus (rat))
BDBM50494706
PNG
(CHEMBL3093268)
Show SMILES Clc1ccccc1N1CCN(CCc2ccccc2)CC1
Show InChI InChI=1S/C18H21ClN2/c19-17-8-4-5-9-18(17)21-14-12-20(13-15-21)11-10-16-6-2-1-3-7-16/h1-9H,10-15H2
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UniChem
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PubMed
67n/an/an/an/an/an/an/an/a



University of Maryland

Curated by ChEMBL


Assay Description
Displacement of [3H](-)-sulpiride from dopamine D2 receptor in rat brain after 120 mins by liquid scintillation counting analysis


Bioorg Med Chem Lett 23: 6920-6922 (2013)


Article DOI: 10.1016/j.bmcl.2013.09.038
BindingDB Entry DOI: 10.7270/Q2J969B5
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A


(Rattus norvegicus (rat))
BDBM50494706
PNG
(CHEMBL3093268)
Show SMILES Clc1ccccc1N1CCN(CCc2ccccc2)CC1
Show InChI InChI=1S/C18H21ClN2/c19-17-8-4-5-9-18(17)21-14-12-20(13-15-21)11-10-16-6-2-1-3-7-16/h1-9H,10-15H2
PDB

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PC sid
UniChem
Article
PubMed
484n/an/an/an/an/an/an/an/a



University of Maryland

Curated by ChEMBL


Assay Description
Displacement of [3H]ketanserin from 5-HT2 receptor in rat brain after 120 mins by liquid scintillation counting analysis


Bioorg Med Chem Lett 23: 6920-6922 (2013)


Article DOI: 10.1016/j.bmcl.2013.09.038
BindingDB Entry DOI: 10.7270/Q2J969B5
More data for this
Ligand-Target Pair
Sodium-dependent serotonin transporter


(Rattus norvegicus (rat))
BDBM50494706
PNG
(CHEMBL3093268)
Show SMILES Clc1ccccc1N1CCN(CCc2ccccc2)CC1
Show InChI InChI=1S/C18H21ClN2/c19-17-8-4-5-9-18(17)21-14-12-20(13-15-21)11-10-16-6-2-1-3-7-16/h1-9H,10-15H2
PDB

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PC sid
UniChem
Article
PubMed
>1.00E+4n/an/an/an/an/an/an/an/a



University of Maryland

Curated by ChEMBL


Assay Description
Displacement of [3H]paroxetine from serotonin transporter in rat brainstem after 120 mins by liquid scintillation counting analysis


Bioorg Med Chem Lett 23: 6920-6922 (2013)


Article DOI: 10.1016/j.bmcl.2013.09.038
BindingDB Entry DOI: 10.7270/Q2J969B5
More data for this
Ligand-Target Pair