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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 = 'BDBM50249189'   
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))
BDBM50249189
PNG
(CHEMBL4071084)
Show SMILES Cc1nc(ccc1[C@@H](O)CN1CCC2(CCN(C2=O)c2ccc(=O)n(C)n2)CC1)-n1cnnn1 |r|
Show InChI InChI=1S/C22H27N9O3/c1-15-16(3-4-18(24-15)31-14-23-26-27-31)17(32)13-29-10-7-22(8-11-29)9-12-30(21(22)34)19-5-6-20(33)28(2)25-19/h3-6,14,17,32H,7-13H2,1-2H3/t17-/m0/s1
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Similars

Article
PubMed
n/an/a 1.72E+4n/an/an/an/an/an/a



Merck& Co.

Curated by ChEMBL


Assay Description
Displacement of [35S]MK499 from human ERG expressed in HEK293 cells


Bioorg Med Chem Lett 27: 2559-2566 (2017)


Article DOI: 10.1016/j.bmcl.2017.03.086
BindingDB Entry DOI: 10.7270/Q2BV7K1G
More data for this
Ligand-Target Pair