BindingDB logo
myBDB logout

BDBM50172268 4-(3-(S)-1-Pyrrolidin-2-ylmethyl-indole-1-sulfonyl)-phenylamine::CHEMBL427184

SMILES: Nc1ccc(cc1)S(=O)(=O)n1cc(C[C@@H]2CCCN2)c2ccccc12

InChI Key: InChIKey=QDSCCNYUEDYRQW-INIZCTEOSA-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 = 50172268   
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))
BDBM50172268
PNG
(4-(3-(S)-1-Pyrrolidin-2-ylmethyl-indole-1-sulfonyl...)
Show SMILES Nc1ccc(cc1)S(=O)(=O)n1cc(C[C@@H]2CCCN2)c2ccccc12
Show InChI InChI=1S/C19H21N3O2S/c20-15-7-9-17(10-8-15)25(23,24)22-13-14(12-16-4-3-11-21-16)18-5-1-2-6-19(18)22/h1-2,5-10,13,16,21H,3-4,11-12,20H2/t16-/m0/s1
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
7n/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))
BDBM50172268
PNG
(4-(3-(S)-1-Pyrrolidin-2-ylmethyl-indole-1-sulfonyl...)
Show SMILES Nc1ccc(cc1)S(=O)(=O)n1cc(C[C@@H]2CCCN2)c2ccccc12
Show InChI InChI=1S/C19H21N3O2S/c20-15-7-9-17(10-8-15)25(23,24)22-13-14(12-16-4-3-11-21-16)18-5-1-2-6-19(18)22/h1-2,5-10,13,16,21H,3-4,11-12,20H2/t16-/m0/s1
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 7.60n/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