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Target
Plasmepsin II
Ligand
BDBM50316598
Substrate
n/a
Meas. Tech.
ChEMBL_1856924 (CHEMBL4357653)
IC50
333±n/a nM
Citation
 Cheuka, PM; Dziwornu, G; Okombo, J; Chibale, K Plasmepsin Inhibitors in Antimalarial Drug Discovery: Medicinal Chemistry and Target Validation (2000 to Present). J Med Chem 63:4445-4467 (2020) [PubMed]  Article 
Target
Name:
Plasmepsin II
Synonyms:
Aspartic hemoglobinase II | PFAPD | PLM2_PLAFX | PMII | Plasmepsin 2 | Plasmepsin 2 (PM-II) | Plasmepsin-II
Type:
Enzyme
Mol. Mass.:
51482.09
Organism:
Plasmodium falciparum
Description:
P46925
Residue:
453
Sequence:
MDITVREHDFKHGFIKSNSTFDGLNIDNSKNKKKIQKGFQILYVLLFCSVMCGLFYYVYENVWLQRDNEMNEILKNSEHLTIGFKVENAHDRILKTIKTHKLKNYIKESVNFLNSGLTKTNYLGSSNDNIELVDFQNIMFYGDAEVGDNQQPFTFILDTGSANLWVPSVKCTTAGCLTKHLYDSSKSRTYEKDGTKVEMNYVSGTVSGFFSKDLVTVGNLSLPYKFIEVIDTNGFEPTYTASTFDGILGLGWKDLSIGSVDPIVVELKNQNKIENALFTFYLPVHDKHTGFLTIGGIEERFYEGPLTYEKLNHDLYWQITLDAHVGNIMLEKANCIVDSGTSAITVPTDFLNKMLQNLDVIKVPFLPFYVTLCNNSKLPTFEFTSENGKYTLEPEYYLQHIEDVGPGLCMLNIIGLDFPVPTFILGDPFMRKYFTVFDYDNHSVGIALAKKNL
  
Inhibitor
Name:
BDBM50316598
Synonyms:
CHEMBL1098670 | N-((S)-1-((2S,3S)-5-((S)-1-((S)-1-amino-4-methyl-1-oxopentan-2-ylamino)-1-oxopent-4-yn-2-ylamino)-3-hydroxy-5-oxo-1-phenylpentan-2-ylamino)-3-methyl-1-oxobutan-2-yl)picolinamide
Type:
Small organic molecule
Emp. Form.:
C33H44N6O6
Mol. Mass.:
620.7391
SMILES:
CC(C)C[C@H](NC(=O)[C@H](CC#C)NC(=O)C[C@H](O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)c1ccccn1)C(C)C)C(N)=O |r|
Structure:
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