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Compile Data Set for Download or QSAR

Found 1 hit of ic50 for monomerid = 50255116   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kJ/mole		IC50
nM		Kd
nM		EC50/IC50
nM		koff
s-1		kon
M-1s-1		pHTemp
°C
Sodium/potassium-transporting ATPase subunit alpha-4/beta-1


(Rattus norvegicus)		BDBM50255116
PNG
(CHEMBL4074239)
Show SMILES [H][C@@]1(O[C@H]2C[C@@H](O)[C@]3(CO)[C@@]4([H])[C@H](O)C[C@]5(C)[C@H](CC[C@]5(O)[C@]4([H])CC[C@]3(O)C2)C(O)c2cn(Cc3ccc(F)cc3)nn2)O[C@@H](C)[C@H](O)[C@@H](O)[C@H]1O |r|
Show InChI InChI=1S/C35H50FN3O11/c1-17-27(43)29(45)30(46)31(49-17)50-20-11-25(42)34(16-40)26-21(7-9-33(34,47)12-20)35(48)10-8-22(32(35,2)13-24(26)41)28(44)23-15-39(38-37-23)14-18-3-5-19(36)6-4-18/h3-6,15,17,20-22,24-31,40-48H,7-14,16H2,1-2H3/t17-,20-,21+,22+,24+,25+,26+,27-,28?,29+,30+,31-,32+,33-,34+,35-/m0/s1
PDB

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PC cid
PC sid
UniChem

Similars
Article
PubMed
n/an/a 13n/an/an/an/an/an/a



Department of Medicinal Chemistry and Institute for Therapeutics Discovery and Development, College of Pharmacy , University of Minnesota , Minneapolis , Minnesota 55414 , United States.

Curated by ChEMBL


Assay Description
Inhibition of recombinant rat Na+/K+-ATPase alpha4/beta1 expressed in baculovirus infected insect Sf9 cell membranes using [gamma-32P]ATP as substrat...

J Med Chem 61: 1800-1820 (2018)


Article DOI: 10.1021/acs.jmedchem.7b00925
BindingDB Entry DOI: 10.7270/Q2T43WJH
More data for this
Ligand-Target Pair