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BDBM50330520 3-(naphthalen-1-ylsulfonyl)-5-(piperazin-1-yl)-1-propyl-1H-indazole::CHEMBL1277752

SMILES: CCCn1nc(c2cc(ccc12)N1CCNCC1)S(=O)(=O)c1cccc2ccccc12

InChI Key: InChIKey=RQMUCGKCHQVFCE-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 = 50330520   
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))
BDBM50330520
PNG
(3-(naphthalen-1-ylsulfonyl)-5-(piperazin-1-yl)-1-p...)
Show SMILES CCCn1nc(c2cc(ccc12)N1CCNCC1)S(=O)(=O)c1cccc2ccccc12
Show InChI InChI=1S/C24H26N4O2S/c1-2-14-28-22-11-10-19(27-15-12-25-13-16-27)17-21(22)24(26-28)31(29,30)23-9-5-7-18-6-3-4-8-20(18)23/h3-11,17,25H,2,12-16H2,1H3
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CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
2.20n/an/an/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Displacement of [3H]LSD from human cloned 5HT6 receptor expressed in human HeLa cells


J Med Chem 53: 7639-46 (2010)


Article DOI: 10.1021/jm1007825
BindingDB Entry DOI: 10.7270/Q2GQ6XZ6
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 6


(Homo sapiens (Human))
BDBM50330520
PNG
(3-(naphthalen-1-ylsulfonyl)-5-(piperazin-1-yl)-1-p...)
Show SMILES CCCn1nc(c2cc(ccc12)N1CCNCC1)S(=O)(=O)c1cccc2ccccc12
Show InChI InChI=1S/C24H26N4O2S/c1-2-14-28-22-11-10-19(27-15-12-25-13-16-27)17-21(22)24(26-28)31(29,30)23-9-5-7-18-6-3-4-8-20(18)23/h3-11,17,25H,2,12-16H2,1H3
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/a 2.20n/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Antagonist activity at human cloned 5HT6 receptor expressed in human HeLa cells by cyclase assay


J Med Chem 53: 7639-46 (2010)


Article DOI: 10.1021/jm1007825
BindingDB Entry DOI: 10.7270/Q2GQ6XZ6
More data for this
Ligand-Target Pair