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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 = 'BDBM50355509'   
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))
BDBM50355509
PNG
(CHEMBL1910311)
Show SMILES Cc1noc(Cn2cc(CN(C3CC3)C(=O)[C@H]3CNCC[C@]3(O)c3ccc(F)c(F)c3)c3c(F)cccc23)n1 |r|
Show InChI InChI=1S/C28H28F3N5O3/c1-16-33-25(39-34-16)15-35-13-17(26-22(30)3-2-4-24(26)35)14-36(19-6-7-19)27(37)20-12-32-10-9-28(20,38)18-5-8-21(29)23(31)11-18/h2-5,8,11,13,19-20,32,38H,6-7,9-10,12,14-15H2,1H3/t20-,28+/m1/s1
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MMDB

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Similars

Article
PubMed
1.90E+3n/an/an/an/an/an/an/an/a



Merck Frosst Centre for Therapeutic Research

Curated by ChEMBL


Assay Description
Binding affinity to human ERG


Bioorg Med Chem Lett 21: 3976-81 (2011)


Article DOI: 10.1016/j.bmcl.2011.05.014
BindingDB Entry DOI: 10.7270/Q21N81HN
More data for this
Ligand-Target Pair