ouabain [Ligand Id: 4826] activity data from GtoPdb and ChEMBL

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ChEMBL ligand: CHEMBL222863 (Ouabain, NSC-25485)
  • Kv11.1/HERG in Human [ChEMBL: CHEMBL240] [GtoPdb: 572] [UniProtKB: Q12809]
  • This target only has 0 pki data point
  • 0
1 CHEMBL222863_lig_chart_1 HERG Human
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  • sodium/potassium-transporting ATPase subunit α-1/sodium/potassium-transporting ATPase subunit β-1/Na+/K+ ATPase alpha-1/beta-1 in Rat [ChEMBL: CHEMBL4106147] [GtoPdb: 833837] [UniProtKB: P06685P07340]
  • This target only has 0 pki data point
  • 0
2 CHEMBL222863_lig_chart_2 Na+/K+ ATPase alpha-1/beta-1 Rat
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  • sodium/potassium-transporting ATPase subunit α-2/sodium/potassium-transporting ATPase subunit β-1/Na+/K+ ATPase alpha-2/beta-1 in Rat [ChEMBL: CHEMBL4106148] [GtoPdb: 834837] [UniProtKB: P06686P07340]
  • This target only has 0 pki data point
  • 0
3 CHEMBL222863_lig_chart_3 Na+/K+ ATPase alpha-2/beta-1 Rat
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  • sodium/potassium-transporting ATPase subunit α-3/sodium/potassium-transporting ATPase subunit β-1/Na+/K+ ATPase alpha-3/beta-1 in Rat [ChEMBL: CHEMBL4106149] [GtoPdb: 835837] [UniProtKB: P06687P07340]
  • This target only has 0 pki data point
  • 0
4 CHEMBL222863_lig_chart_4 Na+/K+ ATPase alpha-3/beta-1 Rat
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  • sodium/potassium-transporting ATPase subunit β-1/sodium/potassium-transporting ATPase subunit α-4/N+/K+ ATPase alpha-4/beta-1 in Rat [ChEMBL: CHEMBL4106165] [GtoPdb: 837836] [UniProtKB: P07340Q64541]
  • This target only has 0 pki data point
  • 0
5 CHEMBL222863_lig_chart_5 N+/K+ ATPase alpha-4/beta-1 Rat
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  • sodium/potassium-transporting ATPase subunit β-3/sodium/potassium-transporting ATPase subunit α-4/N+/K+ ATPase alpha-4/beta-3 in Rat [ChEMBL: CHEMBL4106166] [GtoPdb: 839836] [UniProtKB: Q63377Q64541]
  • This target only has 0 pki data point
  • 0
6 CHEMBL222863_lig_chart_6 N+/K+ ATPase alpha-4/beta-3 Rat
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  • Plasmodium falciparum [ChEMBL: CHEMBL364]
  • This target only has 0 pki data point
  • 0
7 CHEMBL222863_lig_chart_7 Plasmodium falciparum Plasmodium falciparum
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  • sodium/potassium-transporting ATPase subunit α-1/sodium/potassium-transporting ATPase subunit β-1/sodium/potassium-transporting ATPase subunit α-3/sodium/potassium-transporting ATPase subunit β-2/sodium/potassium-transporting ATPase subunit α-2/sodium/potassium-transporting ATPase subunit β-3/sodium/potassium-transporting ATPase subunit γ/sodium/potassium-transporting ATPase subunit α-4/Sodium/potassium-transporting ATPase in Human [ChEMBL: CHEMBL2095186] [GtoPdb: 8338378358388348392610836] [UniProtKB: P05023P05026P13637P14415P50993P54709P54710Q13733]
  • This target only has 0 pki data point
  • 0
8 CHEMBL222863_lig_chart_8 Sodium/potassium-transporting ATPase Human
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DB Assay description Assay Type Standard value Standard parameter Original value Original units Original parameter Reference
Kv11.1/HERG in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL240] [GtoPdb: 572] [UniProtKB: Q12809]
ChEMBL Displacement of Tracer Red from human ERG expressed in cell membranes by fluorescence polarization assay B 5.24 pIC50 5800 nM IC50 J Med Chem (2018) 61: 1800-1820 [PMID:29291372]
sodium/potassium-transporting ATPase subunit α-1/sodium/potassium-transporting ATPase subunit β-1/Na+/K+ ATPase alpha-1/beta-1 in Rat (target type: PROTEIN COMPLEX) [ChEMBL: CHEMBL4106147] [GtoPdb: 833837] [UniProtKB: P06685P07340]
ChEMBL Inhibition of recombinant rat Na+/K+-ATPase alpha1/beta1 expressed in baculovirus infected insect Sf9 cell membranes using [gamma-32P]ATP as substrate preincubated for 20 mins followed by substrate addition measured after 30 mins by liquid scintillation counting B 5.37 pIC50 4300 nM IC50 J Med Chem (2018) 61: 1800-1820 [PMID:29291372]
sodium/potassium-transporting ATPase subunit α-2/sodium/potassium-transporting ATPase subunit β-1/Na+/K+ ATPase alpha-2/beta-1 in Rat (target type: PROTEIN COMPLEX) [ChEMBL: CHEMBL4106148] [GtoPdb: 834837] [UniProtKB: P06686P07340]
ChEMBL Inhibition of recombinant rat Na+/K+-ATPase alpha2/beta1 expressed in baculovirus infected insect Sf9 cell membranes using [gamma-32P]ATP as substrate preincubated for 20 mins followed by substrate addition measured after 30 mins by liquid scintillation counting B 6.77 pIC50 170 nM IC50 J Med Chem (2018) 61: 1800-1820 [PMID:29291372]
sodium/potassium-transporting ATPase subunit α-3/sodium/potassium-transporting ATPase subunit β-1/Na+/K+ ATPase alpha-3/beta-1 in Rat (target type: PROTEIN COMPLEX) [ChEMBL: CHEMBL4106149] [GtoPdb: 835837] [UniProtKB: P06687P07340]
ChEMBL Inhibition of recombinant rat Na+/K+-ATPase alpha3/beta1 expressed in baculovirus infected insect Sf9 cell membranes using [gamma-32P]ATP as substrate preincubated for 20 mins followed by substrate addition measured after 30 mins by liquid scintillation counting B 7.51 pIC50 31 nM IC50 J Med Chem (2018) 61: 1800-1820 [PMID:29291372]
sodium/potassium-transporting ATPase subunit β-1/sodium/potassium-transporting ATPase subunit α-4/N+/K+ ATPase alpha-4/beta-1 in Rat (target type: PROTEIN COMPLEX) [ChEMBL: CHEMBL4106165] [GtoPdb: 837836] [UniProtKB: P07340Q64541]
ChEMBL Inhibition of recombinant rat Na+/K+-ATPase alpha4/beta1 expressed in baculovirus infected insect Sf9 cell membranes using [gamma-32P]ATP as substrate preincubated for 10 mins followed by substrate addition measured after 30 mins in presence of Na+, K+ and Mg2+ by liquid scintillation counting B 8.37 pIC50 4.3 nM IC50 J Med Chem (2018) 61: 1800-1820 [PMID:29291372]
sodium/potassium-transporting ATPase subunit β-3/sodium/potassium-transporting ATPase subunit α-4/N+/K+ ATPase alpha-4/beta-3 in Rat (target type: PROTEIN COMPLEX) [ChEMBL: CHEMBL4106166] [GtoPdb: 839836] [UniProtKB: Q63377Q64541]
ChEMBL Inhibition of recombinant rat Na+/K+-ATPase alpha4/beta3 expressed in baculovirus infected Sf9 cell membranes using [gamma-32P]ATP as substrate preincubated for 20 mins followed by substrate addition measured after 30 mins by liquid scintillation counting B 8.74 pIC50 1.8 nM IC50 J Med Chem (2018) 61: 1800-1820 [PMID:29291372]
Plasmodium falciparum (target type: ORGANISM) [ChEMBL: CHEMBL364]
ChEMBL Antiplasmodial activity against Plasmodium falciparum 3D7 after 72 hrs by SYBR green assay F 4.9 pIC50 12589.25 nM IC50 Nat. Chem. Biol. (2009) 5: 765-771 [PMID:19734910]
ChEMBL Antiplasmodial activity against Plasmodium falciparum 7G8 after 72 hrs by SYBR green assay F 4.9 pIC50 12589.25 nM IC50 Nat. Chem. Biol. (2009) 5: 765-771 [PMID:19734910]
sodium/potassium-transporting ATPase subunit α-1/sodium/potassium-transporting ATPase subunit β-1/sodium/potassium-transporting ATPase subunit α-3/sodium/potassium-transporting ATPase subunit β-2/sodium/potassium-transporting ATPase subunit α-2/sodium/potassium-transporting ATPase subunit β-3/sodium/potassium-transporting ATPase subunit γ/sodium/potassium-transporting ATPase subunit α-4/Sodium/potassium-transporting ATPase in Human (target type: PROTEIN COMPLEX GROUP) [ChEMBL: CHEMBL2095186] [GtoPdb: 8338378358388348392610836] [UniProtKB: P05023P05026P13637P14415P50993P54709P54710Q13733]
ChEMBL Inhibition of KCl-stimulated Na+/K+-ATPase in human placental membrane vesicles measured for 60 secs by 3-O-methylfluorescein phosphate dye based fluorometric method B 5.18 pIC50 6600 nM IC50 J Nat Prod (2017) 80: 1575-1583 [PMID:28452477]
ChEMBL Inhibition of human Na(+)/K(+) ATPase assessed as reduction in ouabain-sensitive and K(+)-dependent cleavage of fluorescent pseudosubstrate 3-O-methylfluorescein phosphate by fluorometric method B 5.22 pIC50 6000 nM IC50 J. Nat. Prod. (2011) 74: 1805-1811 [PMID:21827183]

ChEMBL data shown on this page come from version 28:

Gaulton A, Hersey A, Nowotka M, Bento AP, Chambers J, Mendez D, Mutowo P, Atkinson F, Bellis LJ, CibriƔn-Uhalte E, Davies M, Dedman N, Karlsson A, MagariƱos MP, Overington JP, Papadatos G, Smit I, Leach AR. (2017) 'The ChEMBL database in 2017.' Nucleic Acids Res., 45(D1). DOI: 10.1093/nar/gkw1074. [PMCID:5210557]