| Reaction Details |
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 | Report a problem with these data |
| Target | Potassium-transporting ATPase alpha chain 2 |
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| Ligand | BDBM50131829 |
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| Substrate/Competitor | n/a |
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| Meas. Tech. | ChEMBL_144103 (CHEMBL751507) |
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| IC50 | 6000±n/a nM |
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| Citation |  De Munari, S; Cerri, A; Gobbini, M; Almirante, N; Banfi, L; Carzana, G; Ferrari, P; Marazzi, G; Micheletti, R; Schiavone, A; Sputore, S; Torri, M; Zappavigna, MP; Melloni, P Structure-based design and synthesis of novel potent Na+,K+ -ATPase inhibitors derived from a 5alpha,14alpha-androstane scaffold as positive inotropic compounds. J Med Chem46:3644-54 (2003) [PubMed] Article |
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| More Info.: | Get all data from this article, Assay Method |
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| Potassium-transporting ATPase alpha chain 2 |
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| Name: | Potassium-transporting ATPase alpha chain 2 |
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| Synonyms: | AT12A_HUMAN | ATP12A | ATP1AL1 |
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| Type: | PROTEIN |
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| Mol. Mass.: | 115509.17 |
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| Organism: | Homo sapiens (Human) |
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| Description: | ChEMBL_144101 |
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| Residue: | 1039 |
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| Sequence: | MHQKTPEIYSVELSGTKDIVKTDKGDGKEKYRGLKNNCLELKKKNHKEEFQKELHLDDHK
LSNRELEEKYGTDIIMGLSSTRAAELLARDGPNSLTPPKQTPEIVKFLKQMVGGFSILLW
VGAFLCWIAYGIQYSSDKSASLNNVYLGCVLGLVVILTGIFAYYQEAKSTNIMSSFNKMI
PQQALVIRDSEKKTIPSEQLVVGDIVEVKGGDQIPADIRVLSSQGCRVDNSSLTGESEPQ
PRSSEFTHENPLETKNICFYSTTCLEGTVTGMVINTGDRTIIGHIASLASGVGNEKTPIA
IEIEHFVHIVAGVAVSIGILFFIIAVSLKYQVLDSIIFLIGIIVANVPEGLLATVTVTLS
LTAKRMAKKNCLVKNLEAVETLGSTSIICSDKTGTLTQNRMTVAHLWFDNQIFVADTSED
HSNQVFDQSSRTWASLSKIITLCNRAEFKPGQENVPIMKKAVIGDASETALLKFSEVILG
DVMEIRKRNRKVAEIPFNSTNKFQLSIHEMDDPHGKRFLMVMKGAPERILEKCSTIMING
EEHPLDKSTAKTFHTAYMELGGLGERVLGFCHLYLPADEFPETYSFDIDAMNFPTSNLCF
VGLLSMIDPPRSTVPDAVTKCRSAGIKVIMVTGDHPITAKAIAKSVGIISANSETVEDIA
HRLNIAVEQVNKRDAKAAVVTGMELKDMSSEQLDEILANYQEIVFARTSPQQKLIIVEGC
QRQDAVVAVTGDGVNDSPALKKADIGIAMGIAGSDAAKNAADMVLLDDNFASIVTGVEEG
RLIFDNLKKTIAYSLTKNIAELCPFLIYIIVGLPLPIGTITILFIDLGTDIIPSIALAYE
KAESDIMNRKPRHKNKDRLVNQPLAVYSYLHIGLMQALGAFLVYFTVYAQEGFLPRTLIN
LRVEWEKDYVNDLKDSYGQEWTRYQREYLEWTGYTAFFVGILVQQIADLIIRKTRRNSIF
QQGLFRNKVIWVGITSQIIIGLILSYGLGSVTALSFTMLRAQYWFVAVPHAILIWVYDEV
RKLFIRLYPGSWWDKNMYY
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| BDBM50131829 |
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| n/a |
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| Name | BDBM50131829 |
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| Synonyms: | (E)4,10,13-Trimethyl-tetradecahydro-cyclopenta[a]phenanthrene-3,6,17-trione 3-[O-(2-amino-ethyl)-oxime] | CHEMBL121572 |
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| Type | Small organic molecule |
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| Emp. Form. | C22H34N2O3 |
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| Mol. Mass. | 374.517 |
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| SMILES | C[C@H]1[C@@H]2C(=O)CC3[C@@H]4CCC(=O)[C@@]4(C)CCC3[C@@]2(C)CC\C1=N/OCCN |
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| Structure | 
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