BindingDB logo
myBDB logout

BDBM50172264 3-(1-Benzyl-pyrrolidin-3-yl)-1-(toluene-4-sulfonyl)-1H-indole::CHEMBL194786

SMILES: Cc1ccc(cc1)S(=O)(=O)n1cc(C2CCN(Cc3ccccc3)C2)c2ccccc12

InChI Key: InChIKey=KADCFEDAPDSNRT-UHFFFAOYSA-N

Data: 1 KI  1 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 2 hits for monomerid = 50172264   
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 6


(Homo sapiens (Human))
BDBM50172264
PNG
(3-(1-Benzyl-pyrrolidin-3-yl)-1-(toluene-4-sulfonyl...)
Show SMILES Cc1ccc(cc1)S(=O)(=O)n1cc(C2CCN(Cc3ccccc3)C2)c2ccccc12
Show InChI InChI=1S/C26H26N2O2S/c1-20-11-13-23(14-12-20)31(29,30)28-19-25(24-9-5-6-10-26(24)28)22-15-16-27(18-22)17-21-7-3-2-4-8-21/h2-14,19,22H,15-18H2,1H3
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
8n/an/an/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Displacement of [3H]-LSD from cloned human 5-hydroxytryptamine 6 receptor expressed in HeLa cells


Bioorg Med Chem Lett 15: 4780-5 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.028
BindingDB Entry DOI: 10.7270/Q2RN37DD
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 6


(Homo sapiens (Human))
BDBM50172264
PNG
(3-(1-Benzyl-pyrrolidin-3-yl)-1-(toluene-4-sulfonyl...)
Show SMILES Cc1ccc(cc1)S(=O)(=O)n1cc(C2CCN(Cc3ccccc3)C2)c2ccccc12
Show InChI InChI=1S/C26H26N2O2S/c1-20-11-13-23(14-12-20)31(29,30)28-19-25(24-9-5-6-10-26(24)28)22-15-16-27(18-22)17-21-7-3-2-4-8-21/h2-14,19,22H,15-18H2,1H3
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

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



Wyeth Research

Curated by ChEMBL


Assay Description
Inhibition of cAMP production in HeLa cells expressing human 5-HT6 receptor


Bioorg Med Chem Lett 15: 4780-5 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.028
BindingDB Entry DOI: 10.7270/Q2RN37DD
More data for this
Ligand-Target Pair