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BDBM50496407 CHEMBL3127404

SMILES: CN1[C@H](CN(Cc2ccc(Cl)cc2)S(=O)(=O)c2cccc(c2)C#N)CCC1=O

InChI Key: InChIKey=DTIVJQRSEIQARV-SFHVURJKSA-N

Data: 2 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 = 50496407   
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))
BDBM50496407
PNG
(CHEMBL3127404)
Show SMILES CN1[C@H](CN(Cc2ccc(Cl)cc2)S(=O)(=O)c2cccc(c2)C#N)CCC1=O |r|
Show InChI InChI=1S/C20H20ClN3O3S/c1-23-18(9-10-20(23)25)14-24(13-15-5-7-17(21)8-6-15)28(26,27)19-4-2-3-16(11-19)12-22/h2-8,11,18H,9-10,13-14H2,1H3/t18-/m0/s1
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 210n/an/an/an/an/an/a



AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of human Kv1.5 ion channel expressed in CHO cells by patch clamp assay


Bioorg Med Chem Lett 24: 1269-73 (2014)


Article DOI: 10.1016/j.bmcl.2014.01.067
BindingDB Entry DOI: 10.7270/Q2930X4D
More data for this
Ligand-Target Pair
1,3-beta-glucan synthase component GLS2


(Saccharomyces cerevisiae)
BDBM50496407
PNG
(CHEMBL3127404)
Show SMILES CN1[C@H](CN(Cc2ccc(Cl)cc2)S(=O)(=O)c2cccc(c2)C#N)CCC1=O |r|
Show InChI InChI=1S/C20H20ClN3O3S/c1-23-18(9-10-20(23)25)14-24(13-15-5-7-17(21)8-6-15)28(26,27)19-4-2-3-16(11-19)12-22/h2-8,11,18H,9-10,13-14H2,1H3/t18-/m0/s1
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 3.00E+4n/an/an/an/an/an/a



AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of human ERG


Bioorg Med Chem Lett 24: 1269-73 (2014)


Article DOI: 10.1016/j.bmcl.2014.01.067
BindingDB Entry DOI: 10.7270/Q2930X4D
More data for this
Ligand-Target Pair