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SMILES: C[C@@H]1Cc2cc(ccc2C(=O)O1)C1CN2CCN(CC2(C)CO1)C(=O)Cc1ccc(nc1)-n1cnnn1

InChI Key: InChIKey=PHCVCCVRQHZMBU-TWLNZGNHSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 196077   
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))		BDBM196077
PNG
(US9206199, 182)
Show SMILES C[C@@H]1Cc2cc(ccc2C(=O)O1)C1CN2CCN(CC2(C)CO1)C(=O)Cc1ccc(nc1)-n1cnnn1 |r|
Show InChI InChI=1S/C26H29N7O4/c1-17-9-20-11-19(4-5-21(20)25(35)37-17)22-13-32-8-7-31(14-26(32,2)15-36-22)24(34)10-18-3-6-23(27-12-18)33-16-28-29-30-33/h3-6,11-12,16-17,22H,7-10,13-15H2,1-2H3/t17-,22?,26?/m1/s1
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PC cid
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US Patent
n/an/a 320n/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