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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 = 'BDBM50359169'   
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))
BDBM50359169
PNG
(CHEMBL1923106)
Show SMILES COCCCc1cc(CN(C2CC2)C(=O)[C@H]2CNCC[C@@]22OCc3ccccc23)cc(OCCOC)c1 |r|
Show InChI InChI=1S/C30H40N2O5/c1-34-13-5-6-22-16-23(18-26(17-22)36-15-14-35-2)20-32(25-9-10-25)29(33)28-19-31-12-11-30(28)27-8-4-3-7-24(27)21-37-30/h3-4,7-8,16-18,25,28,31H,5-6,9-15,19-21H2,1-2H3/t28-,30+/m1/s1
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Similars

Article
PubMed
2.00E+4n/an/an/an/an/an/an/an/a



Merck Frosst Centre for Therapeutic Research

Curated by ChEMBL


Assay Description
Inhibition of human ERG


Bioorg Med Chem Lett 21: 7399-404 (2011)


Article DOI: 10.1016/j.bmcl.2011.10.013
BindingDB Entry DOI: 10.7270/Q2PC32SW
More data for this
Ligand-Target Pair