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Found 1 hit Enz. Inhib. hit(s) with Target = 'Sodium/potassium-transporting ATPase subunit alpha-4/beta-1' and Ligand = 'BDBM50255119'   
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)		BDBM50255119
PNG
(CHEMBL4071710)
Show SMILES [H][C@]12OC(C)(C)O[C@@]1([H])[C@]([H])(O[C@H]1C[C@@]3([H])OC(C)(C)OC[C@]33[C@@]4([H])[C@H](O)C[C@]5(C)[C@H](CC[C@]5(O)[C@]4([H])CC[C@]3(O)C1)C1=CC(=O)OC1)O[C@@H](C)[C@@H]2O |r,t:48|
Show InChI InChI=1S/C35H52O12/c1-17-26(38)27-28(47-31(4,5)46-27)29(43-17)44-19-12-23-34(16-42-30(2,3)45-23)25-21(7-9-33(34,39)13-19)35(40)10-8-20(18-11-24(37)41-15-18)32(35,6)14-22(25)36/h11,17,19-23,25-29,36,38-40H,7-10,12-16H2,1-6H3/t17-,19-,20+,21+,22+,23+,25+,26-,27+,28+,29-,32+,33-,34+,35-/m0/s1
PDB

UniProtKB/SwissProt

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PC cid
PC sid
UniChem
Article
PubMed
n/an/a 4n/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