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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 = 'BDBM50255155'   
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))
BDBM50255155
PNG
(CHEMBL4097424)
Show SMILES CN([C@H]1CCCNC1)c1ncc(C(N)=O)c2sc(cc12)-c1ccccc1 |r|
Show InChI InChI=1S/C20H22N4OS/c1-24(14-8-5-9-22-11-14)20-15-10-17(13-6-3-2-4-7-13)26-18(15)16(12-23-20)19(21)25/h2-4,6-7,10,12,14,22H,5,8-9,11H2,1H3,(H2,21,25)/t14-/m0/s1
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Similars

Article
PubMed
n/an/a 2.70E+3n/an/an/an/an/an/a



Oncology Chemistry, IMED Biotech Unit, AstraZeneca , 35 Gatehouse Drive, Waltham, Massachusetts 02451, United States.

Curated by ChEMBL


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


J Med Chem 61: 1061-1073 (2018)


Article DOI: 10.1021/acs.jmedchem.7b01490
BindingDB Entry DOI: 10.7270/Q2PC34T5
More data for this
Ligand-Target Pair