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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 = 'BDBM50231621'   
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))
BDBM50231621
PNG
(CHEMBL256954 | N-(3,5-bis(trifluoromethyl)benzyl)-...)
Show SMILES CC(C)[C@@]1(CC[C@H](C1)N1CCC(CC1)c1ccncn1)C(=O)NCc1cc(cc(c1)C(F)(F)F)C(F)(F)F
Show InChI InChI=1S/C27H32F6N4O/c1-17(2)25(7-3-22(14-25)37-9-5-19(6-10-37)23-4-8-34-16-36-23)24(38)35-15-18-11-20(26(28,29)30)13-21(12-18)27(31,32)33/h4,8,11-13,16-17,19,22H,3,5-7,9-10,14-15H2,1-2H3,(H,35,38)/t22-,25+/m1/s1
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Merck Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [33S]MK499 from human ERG expressed in HEK cells


Bioorg Med Chem Lett 18: 994-8 (2008)


Article DOI: 10.1016/j.bmcl.2007.12.029
BindingDB Entry DOI: 10.7270/Q2SQ9046
More data for this
Ligand-Target Pair