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BDBM50325937 CHEMBL1224227::rac-N-methyl-3-(naphthalen-2-yl)-3-(2H-tetrazol-2-yl)propan-1-amine

SMILES: CNCCC(c1ccc2ccccc2c1)n1ncnn1

InChI Key: InChIKey=DKLPATDCBOSBMT-UHFFFAOYSA-N

Data: 3 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50325937   
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


(Homo sapiens (Human))
BDBM50325937
PNG
(CHEMBL1224227 | rac-N-methyl-3-(naphthalen-2-yl)-3...)
Show SMILES CNCCC(c1ccc2ccccc2c1)n1ncnn1
Show InChI InChI=1S/C15H17N5/c1-16-9-8-15(20-18-11-17-19-20)14-7-6-12-4-2-3-5-13(12)10-14/h2-7,10-11,15-16H,8-9H2,1H3
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KEGG

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PC sid
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Article
PubMed
n/an/a 32n/an/an/an/an/an/a



Korea Institute of Science and Technology

Curated by ChEMBL


Assay Description
Inhibition of serotonin reuptake at human SERT expressed in HEK293 cells


Bioorg Med Chem Lett 20: 5567-71 (2010)


Article DOI: 10.1016/j.bmcl.2010.07.021
BindingDB Entry DOI: 10.7270/Q24F1RQ7
More data for this
Ligand-Target Pair
Sodium-dependent dopamine transporter


(Homo sapiens (Human))
BDBM50325937
PNG
(CHEMBL1224227 | rac-N-methyl-3-(naphthalen-2-yl)-3...)
Show SMILES CNCCC(c1ccc2ccccc2c1)n1ncnn1
Show InChI InChI=1S/C15H17N5/c1-16-9-8-15(20-18-11-17-19-20)14-7-6-12-4-2-3-5-13(12)10-14/h2-7,10-11,15-16H,8-9H2,1H3
NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


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Article
PubMed
n/an/a 1.24E+3n/an/an/an/an/an/a



Korea Institute of Science and Technology

Curated by ChEMBL


Assay Description
Inhibition of dopamine reuptake at human dopamine transporter expressed in CHO cells


Bioorg Med Chem Lett 20: 5567-71 (2010)


Article DOI: 10.1016/j.bmcl.2010.07.021
BindingDB Entry DOI: 10.7270/Q24F1RQ7
More data for this
Ligand-Target Pair
Sodium-dependent noradrenaline transporter


(Homo sapiens (Human))
BDBM50325937
PNG
(CHEMBL1224227 | rac-N-methyl-3-(naphthalen-2-yl)-3...)
Show SMILES CNCCC(c1ccc2ccccc2c1)n1ncnn1
Show InChI InChI=1S/C15H17N5/c1-16-9-8-15(20-18-11-17-19-20)14-7-6-12-4-2-3-5-13(12)10-14/h2-7,10-11,15-16H,8-9H2,1H3
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/a 13.3n/an/an/an/an/an/a



Korea Institute of Science and Technology

Curated by ChEMBL


Assay Description
Inhibition of norepinephrine reuptake at human NET expressed in MDCK cells


Bioorg Med Chem Lett 20: 5567-71 (2010)


Article DOI: 10.1016/j.bmcl.2010.07.021
BindingDB Entry DOI: 10.7270/Q24F1RQ7
More data for this
Ligand-Target Pair