Reaction Details Report a problem with these data
Target
Plasmepsin II
Ligand
BDBM50145185
Substrate
n/a
Meas. Tech.
ChEMBL_1553805 (CHEMBL3767020)
IC50
24000±n/a nM
Citation
 Rasina, D; Otikovs, M; Leitans, J; Recacha, R; Borysov, OV; Kanepe-Lapsa, I; Domraceva, I; Pantelejevs, T; Tars, K; Blackman, MJ; Jaudzems, K; Jirgensons, A Fragment-Based Discovery of 2-Aminoquinazolin-4(3H)-ones As Novel Class Nonpeptidomimetic Inhibitors of the Plasmepsins I, II, and IV. J Med Chem 59:374-87 (2016) [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:
BDBM50145185
Synonyms:
CHEMBL3764748
Type:
Small organic molecule
Emp. Form.:
C9H12ClN3O3
Mol. Mass.:
245.663
SMILES:
NCC(O)CNc1ccc(cc1Cl)[N+]([O-])=O
Structure:
Search PDB for entries with ligand similarity: