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TargetCholine kinase
LigandBDBM50166172
Substrate/Competitorn/a
Meas. Tech.ChEMBL_1714829 (CHEMBL4124878)
IC50 1750±n/a nM
Citation Schiafino-Ortega, SBaglioni, EPérez-Moreno, GMarco, PRMarco, CGonzález-Pacanowska, DRuiz-Pérez, LMCarrasco-Jiménez, MPLópez-Cara, LC 1,2-Diphenoxiethane salts as potent antiplasmodial agents. Bioorg Med Chem Lett28:2485-2489 (2018) [PubMed]  Article
More Info.:Get all data from this article,  Assay Method
 
Choline kinase
Name:Choline kinase
Synonyms:2.7.1.32 | Choline kinase
Type:PROTEIN
Mol. Mass.:52197.43
Organism:Plasmodium falciparum (isolate 3D7)
Description:ChEMBL_118136
Residue:440
Sequence:
MESKICDPIGLDKNKFRKVEEENEENSKIVENGQMTYNDDLEMFTTIQLNQEIDIRKNPF
PLHMINQKNDIPLCAQEFSKLTDPLYIKKICLEKVHDWSRCNEDDVCVNQILSGLTNQLF
EVSIKEDTAIEYRITRRHVLFRIYGKDVDALYNPLSEFEVYKTMSKYRIAPLLLNTFDGG
RIEEWLYGDPLSIDDLKNKSILVGIANVLGKFHTLSRKRHLPEHWDKTPCVFKMMDRWRL
AVSNYKNLDKVTLDINKYIQESHKFLKFIKIYTQIENIANDIVFCHNDLQENNIMNTNKC
LRLIDFEYSGYNFLSADIANFFIETTIDYSYNAYPFFIINKKNYISYESRILFVTTYLSK
YLDDSTAASDQDIIDQFLEAIEVQALGLHLIWAFWSIIRGYQTKSYNEFDFFLYAKERLK
MYDEQKQYLMSKNIIKDYDD
Blast this sequence in BindingDB or PDB
  Blast E-value cutoff:
BDBM50166172
n/a
NameBDBM50166172
Synonyms:Bisquinolinium derivative | CHEMBL192986
TypeSmall organic molecule
Emp. Form.C46H38Cl2N4
Mol. Mass.717.726
SMILESC\[N+](c1ccc(Cl)cc1)=c1\ccn(Cc2ccc(cc2)-c2ccc(Cn3cc\c(=[N+](/C)c4ccc(Cl)cc4)c4ccccc34)cc2)c2ccccc12
Structure
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