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BDBM195984 US9206199, 89

SMILES: Cc1nc(ccc1CC(=O)N1CCN2C[C@@H](OC[C@@H]2C1)c1ccc(F)c([N+]#[C-])c1F)-n1cnnn1

InChI Key: InChIKey=UMBGDTWHQRFWRS-QFBILLFUSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 195984   
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
ATP-sensitive inward rectifier potassium channel 1


(Homo sapiens (Human))
BDBM195984
PNG
(US9206199, 89)
Show SMILES Cc1nc(ccc1CC(=O)N1CCN2C[C@@H](OC[C@@H]2C1)c1ccc(F)c([N+]#[C-])c1F)-n1cnnn1 |r|
Show InChI InChI=1S/C23H22F2N8O2/c1-14-15(3-6-20(28-14)33-13-27-29-30-33)9-21(34)32-8-7-31-11-19(35-12-16(31)10-32)17-4-5-18(24)23(26-2)22(17)25/h3-6,13,16,19H,7-12H2,1H3/t16-,19+/m0/s1
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PC cid
PC sid
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US Patent
n/an/a 70n/an/an/an/an/an/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
The ROMK channel functional thallium flux assay is performed in 384 wells, using the FLIPR-Tetra instrument. HEK-hKir1.1 cells are seeded in Poly-D-L...


US Patent US9206199 (2015)


BindingDB Entry DOI: 10.7270/Q2VH5MND
More data for this
Ligand-Target Pair