Reaction Details Report a problem with these data
Target
Plasmepsin IV [1-448]
Ligand
BDBM50276293
Substrate
n/a
Meas. Tech.
ChEMBL_1715579 (CHEMBL4125628)
Ki
1980±n/a nM
Citation
 Kumar Singh, A; Rajendran, V; Singh, S; Kumar, P; Kumar, Y; Singh, A; Miller, W; Potemkin, V; Poonam, na; Grishina, M; Gupta, N; Kempaiah, P; Durvasula, R; Singh, BK; Dunn, BM; Rathi, B Antiplasmodial activity of hydroxyethylamine analogs: Synthesis, biological activity and structure activity relationship of plasmepsin inhibitors. Bioorg Med Chem 26:3837-3844 (2018) [PubMed]  Article 
Target
Name:
Plasmepsin IV [1-448]
Synonyms:
PLM4_PLAF7 | PMIV | Plasmepsin 4 (PM-IV)
Type:
Enzyme
Mol. Mass.:
50925.00
Organism:
Plasmodium falciparum
Description:
Q8IM16[1-448]
Residue:
448
Sequence:
MALTVKEEEFSNTLIKNASAFDRLKLGNLKNLKIQKKLQFLYLILFVLITGVFFFFLIGNFYSHRKLYQVIKNTKHTTIGFKIDRPHDKVLSSVLKNKLSTYVKESFKFFKSGYAQKGYLGSENDSIELDDVANLMFYGEGQIGTNKQPFMFIFDTGSANLWVPSVNCDSIGCSTKHLYDASASKSYEKDGTKVEISYGSGTVRGYFSKDVISLGDLSLPYKFIEVTDADDLEPIYSGSEFDGILGLGWKDLSIGSIDPVVVELKKQNKIDNALFTFYLPVHDKHVGYLTIGGIESDFYEGPLTYEKLNHDLYWQIDLDIHFGKYVMQKANAVVDSGTSTITAPTSFLNKFFRDMNVIKVPFLPLYVTTCDNDDLPTLEFHSRNNKYTLEPEFYMDPLSDIDPALCMLYILPVDIDDNTFILGDPFMRKYFTVFDYEKESVGFAVAKN
  
Inhibitor
Name:
BDBM50276293
Synonyms:
CHEMBL4125845
Type:
Small organic molecule
Emp. Form.:
C54H66N6O8
Mol. Mass.:
927.1372
SMILES:
CC(C)C[C@H](N1C(=O)c2ccc(C)cc2C1=O)C(=O)N[C@H](Cc1ccccc1)[C@@H](O)CN1CCN(C[C@@H](O)[C@H](Cc2ccccc2)NC(=O)[C@H](CC(C)C)N2C(=O)c3ccc(C)cc3C2=O)CC1 |r|
Structure:
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