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SMILES: Fc1ccccc1S(=O)(=O)c1cn(C2CCNC2)c2ncccc12

InChI Key: InChIKey=VNCIUCWRVXNSTB-UHFFFAOYSA-N

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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50217918   
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))
BDBM50217918
PNG
(3-(2-fluoro-benzenesulfonyl)-1-pyrrolidin-3-yl-1Hp...)
Show SMILES Fc1ccccc1S(=O)(=O)c1cn(C2CCNC2)c2ncccc12 |w:13.13|
Show InChI InChI=1S/C17H16FN3O2S/c18-14-5-1-2-6-15(14)24(22,23)16-11-21(12-7-9-19-10-12)17-13(16)4-3-8-20-17/h1-6,8,11-12,19H,7,9-10H2
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PC sid
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Article
PubMed
2n/an/an/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


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


Bioorg Med Chem 15: 6208-26 (2007)


Article DOI: 10.1016/j.bmc.2007.06.024
BindingDB Entry DOI: 10.7270/Q2HT2P2G
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 6


(Homo sapiens (Human))
BDBM50217918
PNG
(3-(2-fluoro-benzenesulfonyl)-1-pyrrolidin-3-yl-1Hp...)
Show SMILES Fc1ccccc1S(=O)(=O)c1cn(C2CCNC2)c2ncccc12 |w:13.13|
Show InChI InChI=1S/C17H16FN3O2S/c18-14-5-1-2-6-15(14)24(22,23)16-11-21(12-7-9-19-10-12)17-13(16)4-3-8-20-17/h1-6,8,11-12,19H,7,9-10H2
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PubMed
2n/an/an/an/an/an/an/an/a



Islamic Azad University

Curated by ChEMBL


Assay Description
Binding affinity to 5HT6 receptor


Eur J Med Chem 45: 3911-5 (2010)


Article DOI: 10.1016/j.ejmech.2010.05.045
BindingDB Entry DOI: 10.7270/Q27945XK
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 6


(Homo sapiens (Human))
BDBM50217918
PNG
(3-(2-fluoro-benzenesulfonyl)-1-pyrrolidin-3-yl-1Hp...)
Show SMILES Fc1ccccc1S(=O)(=O)c1cn(C2CCNC2)c2ncccc12 |w:13.13|
Show InChI InChI=1S/C17H16FN3O2S/c18-14-5-1-2-6-15(14)24(22,23)16-11-21(12-7-9-19-10-12)17-13(16)4-3-8-20-17/h1-6,8,11-12,19H,7,9-10H2
Reactome pathway
KEGG

UniProtKB/SwissProt

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antibodypedia
GoogleScholar
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PC sid
UniChem

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Article
PubMed
n/an/a 50n/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Antagonist activity at human 5HT6 expressed in HeLa cells assessed as intracellular cAMP level by radioimmunoassay


Bioorg Med Chem 15: 6208-26 (2007)


Article DOI: 10.1016/j.bmc.2007.06.024
BindingDB Entry DOI: 10.7270/Q2HT2P2G
More data for this
Ligand-Target Pair