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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 = 'BDBM247055'   
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))
BDBM247055
PNG
(US9701669, 21)
Show SMILES C[C@H]1OC(=O)[C@@]2(CC(F)(F)[C@@H](C)[C@H](\C=C\c3ccc(cn3)-c3ccccc3C#N)[C@H]12)C(C)(C)C(N)=O |r|
Show InChI InChI=1S/C28H29F2N3O3/c1-16-21(12-11-20-10-9-19(14-33-20)22-8-6-5-7-18(22)13-31)23-17(2)36-25(35)27(23,15-28(16,29)30)26(3,4)24(32)34/h5-12,14,16-17,21,23H,15H2,1-4H3,(H2,32,34)/b12-11+/t16-,17+,21-,23-,27-/m0/s1
PDB
MMDB

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PC cid
PC sid
UniChem
US Patent
n/an/a 2.34E+4n/an/an/an/a7.425



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Drug cardiac arrhythmia is an important safety concern for pharmaceutical development and health regulatory authorities. Blockade of heterologously-e...


US Patent US9701669 (2017)


BindingDB Entry DOI: 10.7270/Q2PC34DS
More data for this
Ligand-Target Pair