Ki Summary BindingDB logo
myBDB logout
Reaction Details
Report a problem with these data
TargetPlasmepsin X
LigandBDBM50591317
Substrate/Competitorn/a
Meas. Tech.ChEMBL_2199854 (CHEMBL5112370)
IC50 7.0±n/a nM
Citation Lowe, MACardenas, AValentin, JPZhu, ZAbendroth, JCastro, JLClass, RDelaunois, AFleurance, RGerets, HGryshkova, VKing, LLorimer, DDMacCoss, MRowley, JHRosseels, MLRoyer, LTaylor, RDWong, MZaccheo, OChavan, VPGhule, GATapkir, BKBurrows, JNDuffey, MRottmann, MWittlin, SAngulo-Barturen, IJiménez-Díaz, MBStriepen, JFairhurst, KJYeo, TFidock, DACowman, AFFavuzza, PCrespo-Fernandez, BGamo, FJGoldberg, DESoldati-Favre, DLaleu, Bde Haro, T Discovery and Characterization of Potent, Efficacious, Orally Available Antimalarial Plasmepsin X Inhibitors and Preclinical Safety Assessment of  J Med Chem65:14121-14143 (2022) [PubMed]  Article
More Info.:Get all data from this article,  Assay Method
 
Plasmepsin X
Name:Plasmepsin X
Synonyms:3.4.23.- | PLM10_PLAF7 | PMX | PfPMX | Plasmepsin 10
Type:PROTEIN
Mol. Mass.:65102.67
Organism:Plasmodium falciparum (isolate 3D7)
Description:ChEMBL_119140
Residue:573
Sequence:
MKRISPLNTLFYLSLFFSYTFKGLKCTRIYKIGTKALPCSECHDVFDCTGCLFEEKESSH
VIPLKLNKKNPNDHKKLQKHHESLKLGDVKYYVNRGEGISGSLGTSSGNTLDDMDLINEE
INKKRTNAQLDEKNFLDFTTYNKNKAQDISDHLSDIQKHVYEQDAQKGNKNFTNNENNSD
NENNSDNENNSDNENNLDNENNLDNENNSDNSSIEKNFIALENKNATVEQTKENIFLVPL
KHLRDSQFVGELLVGTPPQTVYPIFDTGSTNVWVVTTACEEESCKKVRRYDPNKSKTFRR
SFIEKNLHIVFGSGSISGSVGTDTFMLGKHLVRNQTFGLVESESNNNKNGGDNIFDYISF
EGIVGLGFPGMLSAGNIPFFDNLLKQNPNVDPQFSFYISPYDGKSTLIIGGISKSFYEGD
IYMLPVLKESYWEVKLDELYIGKERICCDEESYVIFDTGTSYNTMPSSQMKTFLNLIHST
ACTEQNYKDILKSYPIIKYVFGELIIELHPEEYMILNDDVCMPAYMQIDVPSERNHAYLL
GSLSFMRNFFTVFVRGTESRPSMVGVARAKSKN
Blast this sequence in BindingDB or PDB
  Blast E-value cutoff:
BDBM50591317
n/a
NameBDBM50591317
Synonyms:CHEMBL5191783
TypeSmall organic molecule
Emp. Form.C25H30ClN5O2
Mol. Mass.467.991
SMILESC[C@H]1C[C@H](CCO1)N1C(=O)C[C@](C)(NC1=N)c1cccc(Nc2ccc(nc2)C2CC2)c1Cl |r|
Structure
Search PDB for entries with ligand similarity:Similarity to this molecule at least: