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BDBM50136134 4-[(Naphthalen-1-yloxy)-phenyl-methyl]-piperidine::CHEMBL150932::rac-4-((naphthalen-1-yloxy)(phenyl)methyl)piperidine

SMILES: C1CC(CCN1)C(Oc1cccc2ccccc12)c1ccccc1

InChI Key: InChIKey=KPDJDJHGSVDTMY-UHFFFAOYSA-N

Data: 4 KI  12 IC50

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 16 hits for monomerid = 50136134   
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))
BDBM50136134
PNG
(4-[(Naphthalen-1-yloxy)-phenyl-methyl]-piperidine ...)
Show SMILES C1CC(CCN1)C(Oc1cccc2ccccc12)c1ccccc1
Show InChI InChI=1S/C22H23NO/c1-2-8-18(9-3-1)22(19-13-15-23-16-14-19)24-21-12-6-10-17-7-4-5-11-20(17)21/h1-12,19,22-23H,13-16H2
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8.30n/an/an/an/an/an/an/an/a



FAES FARMA S A

Curated by ChEMBL


Assay Description
Binding affinity to the serotonin transporter (SERT) measured by displacement of [3H]paroxetine in male wistar rats


J Med Chem 46: 5512-32 (2003)


Article DOI: 10.1021/jm0309349
BindingDB Entry DOI: 10.7270/Q2QF8TMN
More data for this
Ligand-Target Pair
Sodium-dependent serotonin transporter


(Rattus norvegicus (rat))
BDBM50136134
PNG
(4-[(Naphthalen-1-yloxy)-phenyl-methyl]-piperidine ...)
Show SMILES C1CC(CCN1)C(Oc1cccc2ccccc12)c1ccccc1
Show InChI InChI=1S/C22H23NO/c1-2-8-18(9-3-1)22(19-13-15-23-16-14-19)24-21-12-6-10-17-7-4-5-11-20(17)21/h1-12,19,22-23H,13-16H2
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20.1n/an/an/an/an/an/an/an/a



FAES FARMA S A

Curated by ChEMBL


Assay Description
Binding affinity to the serotonin transporter (SERT) measured by displacement of [3H]paroxetine in male wistar rats


J Med Chem 46: 5512-32 (2003)


Article DOI: 10.1021/jm0309349
BindingDB Entry DOI: 10.7270/Q2QF8TMN
More data for this
Ligand-Target Pair
Sodium-dependent serotonin transporter


(Rattus norvegicus (rat))
BDBM50136134
PNG
(4-[(Naphthalen-1-yloxy)-phenyl-methyl]-piperidine ...)
Show SMILES C1CC(CCN1)C(Oc1cccc2ccccc12)c1ccccc1
Show InChI InChI=1S/C22H23NO/c1-2-8-18(9-3-1)22(19-13-15-23-16-14-19)24-21-12-6-10-17-7-4-5-11-20(17)21/h1-12,19,22-23H,13-16H2
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28.1n/an/an/an/an/an/an/an/a



FAES FARMA S A

Curated by ChEMBL


Assay Description
Binding affinity to the serotonin transporter (SERT) measured by displacement of [3H]paroxetine in male wistar rats


J Med Chem 46: 5512-32 (2003)


Article DOI: 10.1021/jm0309349
BindingDB Entry DOI: 10.7270/Q2QF8TMN
More data for this
Ligand-Target Pair
Norepinephrine Monoamine transporters


(Rattus norvegicus)
BDBM50136134
PNG
(4-[(Naphthalen-1-yloxy)-phenyl-methyl]-piperidine ...)
Show SMILES C1CC(CCN1)C(Oc1cccc2ccccc12)c1ccccc1
Show InChI InChI=1S/C22H23NO/c1-2-8-18(9-3-1)22(19-13-15-23-16-14-19)24-21-12-6-10-17-7-4-5-11-20(17)21/h1-12,19,22-23H,13-16H2
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417n/an/an/an/an/an/an/an/a



FAES FARMA S A

Curated by ChEMBL


Assay Description
Binding affinity against norepinephrine transporter (NET) by displacement of [3H]nisoxetine in male wistar rats


J Med Chem 46: 5512-32 (2003)


Article DOI: 10.1021/jm0309349
BindingDB Entry DOI: 10.7270/Q2QF8TMN
More data for this
Ligand-Target Pair
Sodium-dependent dopamine transporter


(Rattus norvegicus (rat))
BDBM50136134
PNG
(4-[(Naphthalen-1-yloxy)-phenyl-methyl]-piperidine ...)
Show SMILES C1CC(CCN1)C(Oc1cccc2ccccc12)c1ccccc1
Show InChI InChI=1S/C22H23NO/c1-2-8-18(9-3-1)22(19-13-15-23-16-14-19)24-21-12-6-10-17-7-4-5-11-20(17)21/h1-12,19,22-23H,13-16H2
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n/an/a>1.00E+3n/an/an/an/an/an/a



FAES FARMA S A

Curated by ChEMBL


Assay Description
Binding affinity against dopamine transporter (DAT) by displacement of [3H]WIN-35428 in male wistar rats


J Med Chem 46: 5512-32 (2003)


Article DOI: 10.1021/jm0309349
BindingDB Entry DOI: 10.7270/Q2QF8TMN
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A


(Rattus norvegicus (rat))
BDBM50136134
PNG
(4-[(Naphthalen-1-yloxy)-phenyl-methyl]-piperidine ...)
Show SMILES C1CC(CCN1)C(Oc1cccc2ccccc12)c1ccccc1
Show InChI InChI=1S/C22H23NO/c1-2-8-18(9-3-1)22(19-13-15-23-16-14-19)24-21-12-6-10-17-7-4-5-11-20(17)21/h1-12,19,22-23H,13-16H2
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n/an/a>1.00E+3n/an/an/an/an/an/a



FAES FARMA S A

Curated by ChEMBL


Assay Description
Binding affinity against 5-hydroxytryptamine 2A receptor by displacement of [3H]-ketanserin from rat prefrontal cerebral cortex mambranes


J Med Chem 46: 5512-32 (2003)


Article DOI: 10.1021/jm0309349
BindingDB Entry DOI: 10.7270/Q2QF8TMN
More data for this
Ligand-Target Pair
Norepinephrine Monoamine transporters


(Rattus norvegicus)
BDBM50136134
PNG
(4-[(Naphthalen-1-yloxy)-phenyl-methyl]-piperidine ...)
Show SMILES C1CC(CCN1)C(Oc1cccc2ccccc12)c1ccccc1
Show InChI InChI=1S/C22H23NO/c1-2-8-18(9-3-1)22(19-13-15-23-16-14-19)24-21-12-6-10-17-7-4-5-11-20(17)21/h1-12,19,22-23H,13-16H2
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n/an/a>1.00E+3n/an/an/an/an/an/a



FAES FARMA S A

Curated by ChEMBL


Assay Description
Binding affinity against norepinephrine transporter (NET) by displacement of [3H]nisoxetine in male wistar rats


J Med Chem 46: 5512-32 (2003)


Article DOI: 10.1021/jm0309349
BindingDB Entry DOI: 10.7270/Q2QF8TMN
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Rattus norvegicus (rat))
BDBM50136134
PNG
(4-[(Naphthalen-1-yloxy)-phenyl-methyl]-piperidine ...)
Show SMILES C1CC(CCN1)C(Oc1cccc2ccccc12)c1ccccc1
Show InChI InChI=1S/C22H23NO/c1-2-8-18(9-3-1)22(19-13-15-23-16-14-19)24-21-12-6-10-17-7-4-5-11-20(17)21/h1-12,19,22-23H,13-16H2
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n/an/a>1.00E+3n/an/an/an/an/an/a



FAES FARMA S A

Curated by ChEMBL


Assay Description
Binding affinity against 5-hydroxytryptamine 1A receptor (5-HT1A) by displacement of [3H]8-OH-DPAT from rat hippocampus membranes


J Med Chem 46: 5512-32 (2003)


Article DOI: 10.1021/jm0309349
BindingDB Entry DOI: 10.7270/Q2QF8TMN
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Rattus norvegicus (rat))
BDBM50136134
PNG
(4-[(Naphthalen-1-yloxy)-phenyl-methyl]-piperidine ...)
Show SMILES C1CC(CCN1)C(Oc1cccc2ccccc12)c1ccccc1
Show InChI InChI=1S/C22H23NO/c1-2-8-18(9-3-1)22(19-13-15-23-16-14-19)24-21-12-6-10-17-7-4-5-11-20(17)21/h1-12,19,22-23H,13-16H2
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n/an/a>1.00E+3n/an/an/an/an/an/a



FAES FARMA S A

Curated by ChEMBL


Assay Description
Binding affinity against 5-hydroxytryptamine 1A receptor (5-HT1A) by displacement of [3H]8-OH-DPAT from rat hippocampus membranes


J Med Chem 46: 5512-32 (2003)


Article DOI: 10.1021/jm0309349
BindingDB Entry DOI: 10.7270/Q2QF8TMN
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A


(Rattus norvegicus (rat))
BDBM50136134
PNG
(4-[(Naphthalen-1-yloxy)-phenyl-methyl]-piperidine ...)
Show SMILES C1CC(CCN1)C(Oc1cccc2ccccc12)c1ccccc1
Show InChI InChI=1S/C22H23NO/c1-2-8-18(9-3-1)22(19-13-15-23-16-14-19)24-21-12-6-10-17-7-4-5-11-20(17)21/h1-12,19,22-23H,13-16H2
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n/an/a>1.00E+3n/an/an/an/an/an/a



FAES FARMA S A

Curated by ChEMBL


Assay Description
Binding affinity against 5-hydroxytryptamine 2A receptor by displacement of [3H]-ketanserin from rat prefrontal cerebral cortex mambranes


J Med Chem 46: 5512-32 (2003)


Article DOI: 10.1021/jm0309349
BindingDB Entry DOI: 10.7270/Q2QF8TMN
More data for this
Ligand-Target Pair
Sodium-dependent dopamine transporter


(Rattus norvegicus (rat))
BDBM50136134
PNG
(4-[(Naphthalen-1-yloxy)-phenyl-methyl]-piperidine ...)
Show SMILES C1CC(CCN1)C(Oc1cccc2ccccc12)c1ccccc1
Show InChI InChI=1S/C22H23NO/c1-2-8-18(9-3-1)22(19-13-15-23-16-14-19)24-21-12-6-10-17-7-4-5-11-20(17)21/h1-12,19,22-23H,13-16H2
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n/an/a>1.00E+3n/an/an/an/an/an/a



FAES FARMA S A

Curated by ChEMBL


Assay Description
Binding affinity against dopamine transporter (DAT) by displacement of [3H]WIN-35428 in male wistar rats


J Med Chem 46: 5512-32 (2003)


Article DOI: 10.1021/jm0309349
BindingDB Entry DOI: 10.7270/Q2QF8TMN
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Rattus norvegicus (rat))
BDBM50136134
PNG
(4-[(Naphthalen-1-yloxy)-phenyl-methyl]-piperidine ...)
Show SMILES C1CC(CCN1)C(Oc1cccc2ccccc12)c1ccccc1
Show InChI InChI=1S/C22H23NO/c1-2-8-18(9-3-1)22(19-13-15-23-16-14-19)24-21-12-6-10-17-7-4-5-11-20(17)21/h1-12,19,22-23H,13-16H2
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n/an/a>1.00E+3n/an/an/an/an/an/a



FAES FARMA S A

Curated by ChEMBL


Assay Description
Binding affinity against 5-hydroxytryptamine 1A receptor (5-HT1A) by displacement of [3H]8-OH-DPAT from rat hippocampus membranes


J Med Chem 46: 5512-32 (2003)


Article DOI: 10.1021/jm0309349
BindingDB Entry DOI: 10.7270/Q2QF8TMN
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2A


(Rattus norvegicus (rat))
BDBM50136134
PNG
(4-[(Naphthalen-1-yloxy)-phenyl-methyl]-piperidine ...)
Show SMILES C1CC(CCN1)C(Oc1cccc2ccccc12)c1ccccc1
Show InChI InChI=1S/C22H23NO/c1-2-8-18(9-3-1)22(19-13-15-23-16-14-19)24-21-12-6-10-17-7-4-5-11-20(17)21/h1-12,19,22-23H,13-16H2
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n/an/a>1.00E+3n/an/an/an/an/an/a



FAES FARMA S A

Curated by ChEMBL


Assay Description
Binding affinity against 5-hydroxytryptamine 2A receptor by displacement of [3H]-ketanserin from rat prefrontal cerebral cortex mambranes


J Med Chem 46: 5512-32 (2003)


Article DOI: 10.1021/jm0309349
BindingDB Entry DOI: 10.7270/Q2QF8TMN
More data for this
Ligand-Target Pair
Sodium-dependent dopamine transporter


(Homo sapiens (Human))
BDBM50136134
PNG
(4-[(Naphthalen-1-yloxy)-phenyl-methyl]-piperidine ...)
Show SMILES C1CC(CCN1)C(Oc1cccc2ccccc12)c1ccccc1
Show InChI InChI=1S/C22H23NO/c1-2-8-18(9-3-1)22(19-13-15-23-16-14-19)24-21-12-6-10-17-7-4-5-11-20(17)21/h1-12,19,22-23H,13-16H2
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n/an/a 370n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of [3H]DA uptake at human DAT expressed in HEK293 cells


Bioorg Med Chem Lett 19: 2829-34 (2009)


Article DOI: 10.1016/j.bmcl.2009.03.090
BindingDB Entry DOI: 10.7270/Q2HX1CQX
More data for this
Ligand-Target Pair
Sodium-dependent serotonin transporter


(Homo sapiens (Human))
BDBM50136134
PNG
(4-[(Naphthalen-1-yloxy)-phenyl-methyl]-piperidine ...)
Show SMILES C1CC(CCN1)C(Oc1cccc2ccccc12)c1ccccc1
Show InChI InChI=1S/C22H23NO/c1-2-8-18(9-3-1)22(19-13-15-23-16-14-19)24-21-12-6-10-17-7-4-5-11-20(17)21/h1-12,19,22-23H,13-16H2
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n/an/a 15n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of [3H]5-HT uptake at human 5HTT expressed in HEK293 cells


Bioorg Med Chem Lett 19: 2829-34 (2009)


Article DOI: 10.1016/j.bmcl.2009.03.090
BindingDB Entry DOI: 10.7270/Q2HX1CQX
More data for this
Ligand-Target Pair
Sodium-dependent noradrenaline transporter


(Homo sapiens (Human))
BDBM50136134
PNG
(4-[(Naphthalen-1-yloxy)-phenyl-methyl]-piperidine ...)
Show SMILES C1CC(CCN1)C(Oc1cccc2ccccc12)c1ccccc1
Show InChI InChI=1S/C22H23NO/c1-2-8-18(9-3-1)22(19-13-15-23-16-14-19)24-21-12-6-10-17-7-4-5-11-20(17)21/h1-12,19,22-23H,13-16H2
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n/an/a 120n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of [3H]NA uptake at human NET expressed in HEK293 cells


Bioorg Med Chem Lett 19: 2829-34 (2009)


Article DOI: 10.1016/j.bmcl.2009.03.090
BindingDB Entry DOI: 10.7270/Q2HX1CQX
More data for this
Ligand-Target Pair