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BDBM50331483 CHEMBL1289850::Tetrahydro-pyran-2-carboxylic acid{3-[(6-fluoro-1,1-dioxo-1H-1lambda*6*-benzo[d]isothiazol-3-yl)-phenyl-amino]-2,2-dimethyl-propyl}-amide

SMILES: CC(C)(CNC(=O)C1CCCCO1)CN(C1=NS(=O)(=O)c2cc(F)ccc12)c1ccccc1

InChI Key: InChIKey=IWAGYADOEPALTO-UHFFFAOYSA-N

Data: 2 IC50

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   Substructure
Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50331483   
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
Voltage-gated potassium channel


(Homo sapiens (Human))
BDBM50331483
PNG
(CHEMBL1289850 | Tetrahydro-pyran-2-carboxylic acid...)
Show SMILES CC(C)(CNC(=O)C1CCCCO1)CN(C1=NS(=O)(=O)c2cc(F)ccc12)c1ccccc1 |t:16|
Show InChI InChI=1S/C24H28FN3O4S/c1-24(2,15-26-23(29)20-10-6-7-13-32-20)16-28(18-8-4-3-5-9-18)22-19-12-11-17(25)14-21(19)33(30,31)27-22/h3-5,8-9,11-12,14,20H,6-7,10,13,15-16H2,1-2H3,(H,26,29)
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PC cid
PC sid
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Similars

Article
PubMed
n/an/a 640n/an/an/an/an/an/a



GlaxoSmithKline Research and Development

Curated by ChEMBL


Assay Description
Inhibition of human Kv1.3 ion channel expressed in CGE22 cells


Bioorg Med Chem Lett 20: 6989-92 (2010)


Article DOI: 10.1016/j.bmcl.2010.09.131
BindingDB Entry DOI: 10.7270/Q2HD7VW2
More data for this
Ligand-Target Pair
Voltage-gated potassium channel subunit Kv1.5


(Homo sapiens (Human))
BDBM50331483
PNG
(CHEMBL1289850 | Tetrahydro-pyran-2-carboxylic acid...)
Show SMILES CC(C)(CNC(=O)C1CCCCO1)CN(C1=NS(=O)(=O)c2cc(F)ccc12)c1ccccc1 |t:16|
Show InChI InChI=1S/C24H28FN3O4S/c1-24(2,15-26-23(29)20-10-6-7-13-32-20)16-28(18-8-4-3-5-9-18)22-19-12-11-17(25)14-21(19)33(30,31)27-22/h3-5,8-9,11-12,14,20H,6-7,10,13,15-16H2,1-2H3,(H,26,29)
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 440n/an/an/an/an/an/a



GlaxoSmithKline Research and Development

Curated by ChEMBL


Assay Description
Inhibition of human Kv1.5 ion channel expressed in CHO K1 cells


Bioorg Med Chem Lett 20: 6989-92 (2010)


Article DOI: 10.1016/j.bmcl.2010.09.131
BindingDB Entry DOI: 10.7270/Q2HD7VW2
More data for this
Ligand-Target Pair