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BDBM50150102 CHEMBL126253::[3-(1H-Indol-3-yl)-propyl]-[2-(naphthalen-1-yloxy)-ethyl]-amine

SMILES: C(CNCCOc1cccc2ccccc12)Cc1c[nH]c2ccccc12

InChI Key: InChIKey=LTMYWNLLSXEOLG-UHFFFAOYSA-N

Data: 2 KI  1 IC50  1 EC50

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 4 hits for monomerid = 50150102   
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
5-hydroxytryptamine receptor 1A


(Homo sapiens (Human))
BDBM50150102
PNG
(CHEMBL126253 | [3-(1H-Indol-3-yl)-propyl]-[2-(naph...)
Show SMILES C(CNCCOc1cccc2ccccc12)Cc1c[nH]c2ccccc12
Show InChI InChI=1S/C23H24N2O/c1-2-11-21-18(7-1)8-5-13-23(21)26-16-15-24-14-6-9-19-17-25-22-12-4-3-10-20(19)22/h1-5,7-8,10-13,17,24-25H,6,9,14-16H2
PDB

UniProtKB/SwissProt
UniProtKB/TrEMBL

antibodypedia
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AffyNet 
CHEMBL
PC cid
PC sid
UniChem

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Similars

Article
PubMed
16.8n/an/an/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Binding affinity against human 5-hydroxytryptamine 1A receptor in CHO cells labeled with [3H]-8-OH-DPAT radioligand


J Med Chem 47: 3823-42 (2004)


Article DOI: 10.1021/jm0304010
BindingDB Entry DOI: 10.7270/Q2S46RDW
More data for this
Ligand-Target Pair
Sodium-dependent serotonin transporter


(Rattus norvegicus (rat))
BDBM50150102
PNG
(CHEMBL126253 | [3-(1H-Indol-3-yl)-propyl]-[2-(naph...)
Show SMILES C(CNCCOc1cccc2ccccc12)Cc1c[nH]c2ccccc12
Show InChI InChI=1S/C23H24N2O/c1-2-11-21-18(7-1)8-5-13-23(21)26-16-15-24-14-6-9-19-17-25-22-12-4-3-10-20(19)22/h1-5,7-8,10-13,17,24-25H,6,9,14-16H2
PDB

KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
123n/an/an/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Binding affinity against serotonin transporter in rat cortical tissues using radioligand [3H]-paroxetine


J Med Chem 47: 3823-42 (2004)


Article DOI: 10.1021/jm0304010
BindingDB Entry DOI: 10.7270/Q2S46RDW
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Homo sapiens (Human))
BDBM50150102
PNG
(CHEMBL126253 | [3-(1H-Indol-3-yl)-propyl]-[2-(naph...)
Show SMILES C(CNCCOc1cccc2ccccc12)Cc1c[nH]c2ccccc12
Show InChI InChI=1S/C23H24N2O/c1-2-11-21-18(7-1)8-5-13-23(21)26-16-15-24-14-6-9-19-17-25-22-12-4-3-10-20(19)22/h1-5,7-8,10-13,17,24-25H,6,9,14-16H2
PDB

UniProtKB/SwissProt
UniProtKB/TrEMBL

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/an/an/a 60.8n/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Effective concentration against binding of radioligand [35]GTPgammaS in CHO cells expressing human 5-hydroxytryptamine 1A receptor


J Med Chem 47: 3823-42 (2004)


Article DOI: 10.1021/jm0304010
BindingDB Entry DOI: 10.7270/Q2S46RDW
More data for this
Ligand-Target Pair
Sodium-dependent serotonin transporter


(Homo sapiens (Human))
BDBM50150102
PNG
(CHEMBL126253 | [3-(1H-Indol-3-yl)-propyl]-[2-(naph...)
Show SMILES C(CNCCOc1cccc2ccccc12)Cc1c[nH]c2ccccc12
Show InChI InChI=1S/C23H24N2O/c1-2-11-21-18(7-1)8-5-13-23(21)26-16-15-24-14-6-9-19-17-25-22-12-4-3-10-20(19)22/h1-5,7-8,10-13,17,24-25H,6,9,14-16H2
PDB

KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/a 2.17E+3n/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Inhibition concentration against [3H]-5-HT uptake by human serotonin transporter in JAR cells


J Med Chem 47: 3823-42 (2004)


Article DOI: 10.1021/jm0304010
BindingDB Entry DOI: 10.7270/Q2S46RDW
More data for this
Ligand-Target Pair