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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 = 'BDBM50009216'   
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))
BDBM50009216
PNG
(CHEMBL3233183)
Show SMILES CC(C)N(C)[C@@H]1CC[C@@H]([C@H](CS(C)(=O)=O)C1)N1CC[C@H](NC(=O)c2cccc(OC(F)(F)F)c2)C1=O |r|
Show InChI InChI=1S/C24H34F3N3O5S/c1-15(2)29(3)18-8-9-21(17(12-18)14-36(4,33)34)30-11-10-20(23(30)32)28-22(31)16-6-5-7-19(13-16)35-24(25,26)27/h5-7,13,15,17-18,20-21H,8-12,14H2,1-4H3,(H,28,31)/t17-,18+,20-,21-/m0/s1
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MMDB

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Similars

Article
PubMed
n/an/a>8.00E+4n/an/an/an/an/an/a



Bristol-Myers Squibb Company

Curated by ChEMBL


Assay Description
Inhibition of human ERG by FLIPR assay


Bioorg Med Chem Lett 24: 1843-5 (2014)


Article DOI: 10.1016/j.bmcl.2014.02.013
BindingDB Entry DOI: 10.7270/Q2FQ9Z4P
More data for this
Ligand-Target Pair