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BDBM50132086 2-(3-Phenoxy-propyl)-2,3,4,5-tetrahydro-1H-pyrido[4,3-b]indole::CHEMBL126438

SMILES: C(COc1ccccc1)CN1CCc2[nH]c3ccccc3c2C1

InChI Key: InChIKey=IXCFIKTWJYDNHO-UHFFFAOYSA-N

Data: 3 KI

Find this compound or compounds like it in BindingDB or PDB:
   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 = 50132086   
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 2A


(Rattus norvegicus (rat))
BDBM50132086
PNG
(2-(3-Phenoxy-propyl)-2,3,4,5-tetrahydro-1H-pyrido[...)
Show SMILES C(COc1ccccc1)CN1CCc2[nH]c3ccccc3c2C1
Show InChI InChI=1S/C20H22N2O/c1-2-7-16(8-3-1)23-14-6-12-22-13-11-20-18(15-22)17-9-4-5-10-19(17)21-20/h1-5,7-10,21H,6,11-15H2
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Article
PubMed
20n/an/an/an/an/an/an/an/a



Virginia Commonwealth University

Curated by ChEMBL


Assay Description
Binding affinity towards rat 5-hydroxytryptamine 2A receptor expressed in NIH3T3 cells using [3H]ketanserin as radioligand


J Med Chem 46: 3930-7 (2003)


Article DOI: 10.1021/jm030080s
BindingDB Entry DOI: 10.7270/Q2V1245C
More data for this
Ligand-Target Pair
Serotonin receptor 2a and 2c (5HT2A and 5HT2C)


(Rattus norvegicus (Rat))
BDBM50132086
PNG
(2-(3-Phenoxy-propyl)-2,3,4,5-tetrahydro-1H-pyrido[...)
Show SMILES C(COc1ccccc1)CN1CCc2[nH]c3ccccc3c2C1
Show InChI InChI=1S/C20H22N2O/c1-2-7-16(8-3-1)23-14-6-12-22-13-11-20-18(15-22)17-9-4-5-10-19(17)21-20/h1-5,7-10,21H,6,11-15H2
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Article
PubMed
160n/an/an/an/an/an/an/an/a



Virginia Commonwealth University

Curated by ChEMBL


Assay Description
Binding affinity towards rat 5-hydroxytryptamine 2C receptor expressed in A-9 cells using [3H]mesulergine as radioligand


J Med Chem 46: 3930-7 (2003)


Article DOI: 10.1021/jm030080s
BindingDB Entry DOI: 10.7270/Q2V1245C
More data for this
Ligand-Target Pair
5-HT5


(MOUSE)
BDBM50132086
PNG
(2-(3-Phenoxy-propyl)-2,3,4,5-tetrahydro-1H-pyrido[...)
Show SMILES C(COc1ccccc1)CN1CCc2[nH]c3ccccc3c2C1
Show InChI InChI=1S/C20H22N2O/c1-2-7-16(8-3-1)23-14-6-12-22-13-11-20-18(15-22)17-9-4-5-10-19(17)21-20/h1-5,7-10,21H,6,11-15H2
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Article
PubMed
600n/an/an/an/an/an/an/an/a



Virginia Commonwealth University

Curated by ChEMBL


Assay Description
Binding affinity towards mouse 5-hydroxytryptamine 5A receptor using LSD as radioligand


J Med Chem 46: 3930-7 (2003)


Article DOI: 10.1021/jm030080s
BindingDB Entry DOI: 10.7270/Q2V1245C
More data for this
Ligand-Target Pair