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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 = 'BDBM50460282'   
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))
BDBM50460282
PNG
(CHEMBL4226478)
Show SMILES COc1cc2ccc(Br)cc2cc1[C@@H](c1ccccc1)[C@@](O)(CCN(C)C)c1ccc2occc2c1 |r|
Show InChI InChI=1S/C31H30BrNO3/c1-33(2)15-14-31(34,25-10-12-28-23(17-25)13-16-36-28)30(21-7-5-4-6-8-21)27-19-24-18-26(32)11-9-22(24)20-29(27)35-3/h4-13,16-20,30,34H,14-15H2,1-3H3/t30-,31-/m1/s1
PDB
MMDB

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PC cid
PC sid
UniChem
Article
PubMed
n/an/a 400n/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