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SMILES: Cc1c2COC(=O)c2ccc1[C@@H](O)CN[C@@H]1CCN(CC(O)c2ccc(cn2)C#N)C1

InChI Key: InChIKey=IYPSIBVXIRMPDN-NKWVPACGSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 161038   
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))		BDBM161038
PNG
(US9108947, 12)
Show SMILES Cc1c2COC(=O)c2ccc1[C@@H](O)CN[C@@H]1CCN(CC(O)c2ccc(cn2)C#N)C1 |r|
Show InChI InChI=1S/C23H26N4O4/c1-14-17(3-4-18-19(14)13-31-23(18)30)21(28)10-25-16-6-7-27(11-16)12-22(29)20-5-2-15(8-24)9-26-20/h2-5,9,16,21-22,25,28-29H,6-7,10-13H2,1H3/t16-,21+,22?/m1/s1
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Similars
US Patent
n/an/a 1.37E+3n/an/an/an/a7.437



Merck Sharp & Dohme Corp.

US Patent


Assay Description
Block of Kir1.1 (ROMK1) currents was examined by whole cell voltage clamp (Hamill et. al. Pfluegers Archives 391:85-100 (1981)) using the IonWorks.RT...

US Patent US9108947 (2015)


BindingDB Entry DOI: 10.7270/Q2V40SZT
More data for this
Ligand-Target Pair