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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Potassium voltage-gated channel subfamily H member 2' and Ligand = 'BDBM50247692'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Potassium voltage-gated channel subfamily H member 2


(Homo sapiens (Human))
BDBM50247692
PNG
(CHEMBL4068300)
Show SMILES CCOC(=O)C1=C(CN2CCOCC2C(O)=O)NC(=NC1c1ccc(F)cc1Cl)c1nccs1 |c:5,19|
Show InChI InChI=1S/C22H22ClFN4O5S/c1-2-33-22(31)17-15(10-28-6-7-32-11-16(28)21(29)30)26-19(20-25-5-8-34-20)27-18(17)13-4-3-12(24)9-14(13)23/h3-5,8-9,16,18H,2,6-7,10-11H2,1H3,(H,26,27)(H,29,30)
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Article
PubMed
n/an/a>1.00E+4n/an/an/an/an/an/a



HEC Pharma Group

Curated by ChEMBL


Assay Description
Inhibition of human ERG expressed in HEK293 cells at -80 mV holding potential by manual-patch-clamp electrophysiology assay


J Med Chem 61: 1355-1374 (2018)


Article DOI: 10.1021/acs.jmedchem.7b01914
BindingDB Entry DOI: 10.7270/Q2XS5XS9
More data for this
Ligand-Target Pair