ouabain [Ligand Id: 4826] activity data from GtoPdb and ChEMBL
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| ChEMBL ligand: CHEMBL222863 (NSC-25485, Ouabain) |
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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: 833, 837] [UniProtKB: P06685, P07340] | ||||||||
| 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: 834, 837] [UniProtKB: P06686, P07340] | ||||||||
| 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: 835, 837] [UniProtKB: P06687, P07340] | ||||||||
| 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: 837, 836] [UniProtKB: P07340, Q64541] | ||||||||
| 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: 839, 836] [UniProtKB: Q63377, Q64541] | ||||||||
| 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: 833, 837, 835, 838, 834, 839, 2610, 836] [UniProtKB: P05023, P05026, P13637, P14415, P50993, P54709, P54710, Q13733] | ||||||||
| 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 33:
Mendez D, Gaulton A, Bento AP, Chambers J, De Veij M, Félix E, Magariños MP, Mosquera JF, Mutowo P, Nowotka M, Gordillo-Marañón M, Hunter F, Junco L, Mugumbate G, Rodriguez-Lopez M, Atkinson F, Bosc N, Radoux CJ, Segura-Cabrera A, Hersey A, Leach AR. (2019) 'ChEMBL: towards direct deposition of bioassay data' Nucleic Acids Res., 47(D1). DOI: 10.1093/nar/gky1075. [EPMCID:30398643]
Davies M, Nowotka M, Papadatos G, Dedman N, Gaulton A, Atkinson F, Bellis L, Overington JP. (2015) 'ChEMBL web services: streamlining access to drug discovery data and utilities.' Nucleic Acids Res., 43(W1). DOI: 10.1093/nar/gkv352. [EPMCID:25883136]
