Ki Summary BindingDB logo
myBDB logout
Reaction Details
Report a problem with these data
TargetChloroquine resistance transporter
LigandBDBM50563442
Substrate/Competitorn/a
Meas. Tech.ChEMBL_2082532 (CHEMBL4738323)
IC50 15600±n/a nM
Citation Relitti, NFederico, SPozzetti, LButini, SLamponi, STaramelli, DD'Alessandro, SMartin, REShafik, SHSummers, RLBabij, SKHabluetzel, ATapanelli, SCaldelari, RGemma, SCampiani, G Synthesis and biological evaluation of benzhydryl-based antiplasmodial agents possessing Plasmodium falciparum chloroquine resistance transporter (PfCRT) inhibitory activity. Eur J Med Chem215:0 (2021) [PubMed]  Article
More Info.:Get all data from this article,  Assay Method
 
Chloroquine resistance transporter
Name:Chloroquine resistance transporter
Synonyms:CRT | CRT_PLAFA | PfCRT
Type:PROTEIN
Mol. Mass.:48687.29
Organism:Plasmodium falciparum
Description:ChEMBL_1364181
Residue:424
Sequence:
MKFASKKNNQKNSSKNDERYRELDNLVQEGNGSRLGGGSCLGKCAHVFKLIFKEIKDNIF
IYILSIIYLSVCVMNKIFAKRTLNKIGNYSFVTSETHNFICMIMFFIVYSLFGNKKGNSK
ERHRSFNLQFFAISMLDACSVILAFIGLTRTTGNIQSFVLQLSIPINMFFCFLILRYRYH
LYNYLGAVIIVVTIALVEMKLSFETQEENSIIFNLVLISALIPVCFSNMTREIVFKKYKI
DILRLNAMVSFFQLFTSCLILPVYTLPFLKQLHLPYNEIWTNIKNGFACLFLGRNTVVEN
CGLGMAKLCDDCDGAWKTFALFSFFNICDNLITSYIIDKFSTMTYTIVSCIQGPAIAIAY
YFKFLAGDVVREPRLLDFVTLFGYLFGSIIYRVGNIILERKKMRNEENEDSEGELTNVDS
IITQ
Blast this sequence in BindingDB or PDB
  Blast E-value cutoff:
BDBM50563442
n/a
NameBDBM50563442
Synonyms:CHEMBL4754685
TypeSmall organic molecule
Emp. Form.C50H42Cl4N6
Mol. Mass.868.721
SMILESClc1ccc(cc1)C(Nc1ccnc2cc(Cl)ccc12)c1ccc(CN2CCN(Cc3ccc(cc3)C(Nc3ccnc4cc(Cl)ccc34)c3cccc(Cl)c3)CC2)cc1
Structure
Search PDB for entries with ligand similarity:Similarity to this molecule at least: