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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 = 'BDBM50460273'   
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))
BDBM50460273
PNG
(CHEMBL4227597)
Show SMILES COc1cc2ccc(Br)cc2cc1[C@@H](c1ccccc1)[C@@](O)(CCN(C)C)c1cccc2CCCc12 |r|
Show InChI InChI=1S/C32H34BrNO2/c1-34(2)18-17-32(35,29-14-8-12-22-11-7-13-27(22)29)31(23-9-5-4-6-10-23)28-20-25-19-26(33)16-15-24(25)21-30(28)36-3/h4-6,8-10,12,14-16,19-21,31,35H,7,11,13,17-18H2,1-3H3/t31-,32-/m1/s1
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PC cid
PC sid
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Article
PubMed
n/an/a 3.80E+3n/an/an/an/an/an/a



University of Auckland

Curated by ChEMBL


Assay Description
Inhibition of human ERG by patch clamp assay


Bioorg Med Chem 26: 1797-1809 (2018)


Article DOI: 10.1016/j.bmc.2018.02.026
BindingDB Entry DOI: 10.7270/Q2TQ645G
More data for this
Ligand-Target Pair