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BDBM50331486 1-Methyl-1H-imidazole-2-carboxylic acid{3-[(6-fluoro-1,1-dioxo-1H-1lambda*6*-benzo[d]isothiazol-3-yl)-phenyl-amino]-2,2-dimethyl-propyl}-amide::CHEMBL1289070

SMILES: Cn1ccnc1C(=O)NCC(C)(C)CN(C1=NS(=O)(=O)c2cc(F)ccc12)c1ccccc1

InChI Key: InChIKey=MRFUMRJHDPXIAR-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 = 50331486   
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))
BDBM50331486
PNG
(1-Methyl-1H-imidazole-2-carboxylic acid{3-[(6-fluo...)
Show SMILES Cn1ccnc1C(=O)NCC(C)(C)CN(C1=NS(=O)(=O)c2cc(F)ccc12)c1ccccc1 |t:16|
Show InChI InChI=1S/C23H24FN5O3S/c1-23(2,14-26-22(30)21-25-11-12-28(21)3)15-29(17-7-5-4-6-8-17)20-18-10-9-16(24)13-19(18)33(31,32)27-20/h4-13H,14-15H2,1-3H3,(H,26,30)
PDB
MMDB

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PC cid
PC sid
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Similars

Article
PubMed
n/an/a 550n/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))
BDBM50331486
PNG
(1-Methyl-1H-imidazole-2-carboxylic acid{3-[(6-fluo...)
Show SMILES Cn1ccnc1C(=O)NCC(C)(C)CN(C1=NS(=O)(=O)c2cc(F)ccc12)c1ccccc1 |t:16|
Show InChI InChI=1S/C23H24FN5O3S/c1-23(2,14-26-22(30)21-25-11-12-28(21)3)15-29(17-7-5-4-6-8-17)20-18-10-9-16(24)13-19(18)33(31,32)27-20/h4-13H,14-15H2,1-3H3,(H,26,30)
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 520n/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