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SMILES: Cc1c2COC(=O)c2ccc1[C@@H](O)CN1CC2CN(CC(O)c3ccc(cn3)C#N)C2C1

InChI Key: InChIKey=HXYIKMIUGXJBHT-OFHFNKDXSA-N

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Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 254090   
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))		BDBM254090
PNG
(US9493474, 22)
Show SMILES Cc1c2COC(=O)c2ccc1[C@@H](O)CN1CC2CN(CC(O)c3ccc(cn3)C#N)C2C1 |r|
Show InChI InChI=1S/C24H26N4O4/c1-14-17(3-4-18-19(14)13-32-24(18)31)22(29)11-27-8-16-9-28(21(16)10-27)12-23(30)20-5-2-15(6-25)7-26-20/h2-5,7,16,21-23,29-30H,8-13H2,1H3/t16?,21?,22-,23?/m0/s1
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PC cid
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US Patent
n/an/a 916n/an/an/an/an/a37



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 US9493474 (2016)


BindingDB Entry DOI: 10.7270/Q2GT5M3X
More data for this
Ligand-Target Pair