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BDBM50132103 2-(3-Benzyloxy-propyl)-5-methyl-2,3,4,5-tetrahydro-1H-pyrido[4,3-b]indole::CHEMBL338081

SMILES: Cn1c2CCN(CCCOCc3ccccc3)Cc2c2ccccc12

InChI Key: InChIKey=HEBDLMZEGPOGHC-UHFFFAOYSA-N

Data: 3 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 3 hits for monomerid = 50132103   
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))
BDBM50132103
PNG
(2-(3-Benzyloxy-propyl)-5-methyl-2,3,4,5-tetrahydro...)
Show SMILES Cn1c2CCN(CCCOCc3ccccc3)Cc2c2ccccc12
Show InChI InChI=1S/C22H26N2O/c1-23-21-11-6-5-10-19(21)20-16-24(14-12-22(20)23)13-7-15-25-17-18-8-3-2-4-9-18/h2-6,8-11H,7,12-17H2,1H3
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Article
PubMed
225n/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
5-HT5


(MOUSE)
BDBM50132103
PNG
(2-(3-Benzyloxy-propyl)-5-methyl-2,3,4,5-tetrahydro...)
Show SMILES Cn1c2CCN(CCCOCc3ccccc3)Cc2c2ccccc12
Show InChI InChI=1S/C22H26N2O/c1-23-21-11-6-5-10-19(21)20-16-24(14-12-22(20)23)13-7-15-25-17-18-8-3-2-4-9-18/h2-6,8-11H,7,12-17H2,1H3
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Article
PubMed
295n/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
Serotonin receptor 2a and 2c (5HT2A and 5HT2C)


(Rattus norvegicus (Rat))
BDBM50132103
PNG
(2-(3-Benzyloxy-propyl)-5-methyl-2,3,4,5-tetrahydro...)
Show SMILES Cn1c2CCN(CCCOCc3ccccc3)Cc2c2ccccc12
Show InChI InChI=1S/C22H26N2O/c1-23-21-11-6-5-10-19(21)20-16-24(14-12-22(20)23)13-7-15-25-17-18-8-3-2-4-9-18/h2-6,8-11H,7,12-17H2,1H3
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
650n/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