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BDBM50095031 2-Phenyl-3-(2-pyrrolidin-1-yl-ethyl)-1H-indole::CHEMBL90347

SMILES: C(Cc1c([nH]c2ccccc12)-c1ccccc1)N1CCCC1

InChI Key: InChIKey=QGQVKTDTPMQADW-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 = 50095031   
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


(Homo sapiens (Human))
BDBM50095031
PNG
(2-Phenyl-3-(2-pyrrolidin-1-yl-ethyl)-1H-indole | C...)
Show SMILES C(Cc1c([nH]c2ccccc12)-c1ccccc1)N1CCCC1
Show InChI InChI=1S/C20H22N2/c1-2-8-16(9-3-1)20-18(12-15-22-13-6-7-14-22)17-10-4-5-11-19(17)21-20/h1-5,8-11,21H,6-7,12-15H2
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PC cid
PC sid
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PubMed
9n/an/an/an/an/an/an/an/a



Merck Sharp & Dohme Research Laboratories

Curated by ChEMBL


Assay Description
Displacent of [H]-ketanserin from CHO cells expressing human 5-hydroxytryptamine 2A receptor.


Bioorg Med Chem Lett 10: 2697-9 (2000)


BindingDB Entry DOI: 10.7270/Q27943XR
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 2C


(Homo sapiens (Human))
BDBM50095031
PNG
(2-Phenyl-3-(2-pyrrolidin-1-yl-ethyl)-1H-indole | C...)
Show SMILES C(Cc1c([nH]c2ccccc12)-c1ccccc1)N1CCCC1
Show InChI InChI=1S/C20H22N2/c1-2-8-16(9-3-1)20-18(12-15-22-13-6-7-14-22)17-10-4-5-11-19(17)21-20/h1-5,8-11,21H,6-7,12-15H2
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents

PubMed
260n/an/an/an/an/an/an/an/a



Merck Sharp & Dohme Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [H]-mesulergine from CHO cells expressing human 5-hydroxytryptamine 2C receptor.


Bioorg Med Chem Lett 10: 2697-9 (2000)


BindingDB Entry DOI: 10.7270/Q27943XR
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50095031
PNG
(2-Phenyl-3-(2-pyrrolidin-1-yl-ethyl)-1H-indole | C...)
Show SMILES C(Cc1c([nH]c2ccccc12)-c1ccccc1)N1CCCC1
Show InChI InChI=1S/C20H22N2/c1-2-8-16(9-3-1)20-18(12-15-22-13-6-7-14-22)17-10-4-5-11-19(17)21-20/h1-5,8-11,21H,6-7,12-15H2
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents

PubMed
>1.00E+3n/an/an/an/an/an/an/an/a



Merck Sharp & Dohme Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [3H]-spiperone from CHO cells expressing human Dopamine receptor D2.


Bioorg Med Chem Lett 10: 2697-9 (2000)


BindingDB Entry DOI: 10.7270/Q27943XR
More data for this
Ligand-Target Pair