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BDBM247049 US9701669, 5

SMILES: C[C@H]1OC(=O)[C@]2(CC(N)=O)CC(F)(F)[C@@H](C)[C@H](\C=C\c3ccc(cn3)-c3ccccc3C#N)[C@H]12

InChI Key: InChIKey=CCFUVLLOLWMZDY-PAGYRHFNSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 247049   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/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))
BDBM247049
PNG
(US9701669, 5)
Show SMILES C[C@H]1OC(=O)[C@]2(CC(N)=O)CC(F)(F)[C@@H](C)[C@H](\C=C\c3ccc(cn3)-c3ccccc3C#N)[C@H]12 |r|
Show InChI InChI=1S/C26H25F2N3O3/c1-15-20(23-16(2)34-24(33)25(23,11-22(30)32)14-26(15,27)28)10-9-19-8-7-18(13-31-19)21-6-4-3-5-17(21)12-29/h3-10,13,15-16,20,23H,11,14H2,1-2H3,(H2,30,32)/b10-9+/t15-,16+,20-,23-,25+/m0/s1
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PC cid
PC sid
UniChem
US Patent
n/an/a 6.00E+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