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BDBM50330510 3-(2,6-Dichlorophenylsulfonyl)-5-(4-methylpiperazin-1-yl)-1Hindazole::CHEMBL1277011

SMILES: CN1CCN(CC1)c1ccc2[nH]nc(c2c1)S(=O)(=O)c1c(Cl)cccc1Cl

InChI Key: InChIKey=DUVGAHFDIBSNHU-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 = 50330510   
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))
BDBM50330510
PNG
(3-(2,6-Dichlorophenylsulfonyl)-5-(4-methylpiperazi...)
Show SMILES CN1CCN(CC1)c1ccc2[nH]nc(c2c1)S(=O)(=O)c1c(Cl)cccc1Cl
Show InChI InChI=1S/C18H18Cl2N4O2S/c1-23-7-9-24(10-8-23)12-5-6-16-13(11-12)18(22-21-16)27(25,26)17-14(19)3-2-4-15(17)20/h2-6,11H,7-10H2,1H3,(H,21,22)
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KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
2.60n/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))
BDBM50330510
PNG
(3-(2,6-Dichlorophenylsulfonyl)-5-(4-methylpiperazi...)
Show SMILES CN1CCN(CC1)c1ccc2[nH]nc(c2c1)S(=O)(=O)c1c(Cl)cccc1Cl
Show InChI InChI=1S/C18H18Cl2N4O2S/c1-23-7-9-24(10-8-23)12-5-6-16-13(11-12)18(22-21-16)27(25,26)17-14(19)3-2-4-15(17)20/h2-6,11H,7-10H2,1H3,(H,21,22)
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 40n/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