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Compile Data Set for Download or QSAR

Found 2 hits with Last Name = 'marquez' and Initial = 'r'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Pantothenate kinase 1, putative


(Plasmodium falciparum (isolate 3D7))
BDBM50285608
PNG
(CHEMBL4167606)
Show SMILES CC(C)(CO)[C@@H](O)C(=O)N\C=C\C(=O)OCc1ccccc1 |r|
Show InChI InChI=1S/C16H21NO5/c1-16(2,11-18)14(20)15(21)17-9-8-13(19)22-10-12-6-4-3-5-7-12/h3-9,14,18,20H,10-11H2,1-2H3,(H,17,21)/b9-8+/t14-/m0/s1
UniProtKB/TrEMBL

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 140n/an/an/an/an/an/a



The Australian National University

Curated by ChEMBL


Assay Description
Inhibition of pantothenate kinase in Plasmodium falciparum 3D7 trophozoites using [14C]pantothenate as substrate after 15 mins by TopCount scintillat...


Eur J Med Chem 143: 1139-1147 (2018)


Article DOI: 10.1016/j.ejmech.2017.08.050
BindingDB Entry DOI: 10.7270/Q2FX7D11
More data for this
Ligand-Target Pair
Pantothenate kinase 1, putative


(Plasmodium falciparum (isolate 3D7))
BDBM50285609
PNG
(CHEMBL4164243)
Show SMILES CC(C)(CO)[C@@H](O)C(=O)N\C=C\C(O)=O |r|
Show InChI InChI=1S/C9H15NO5/c1-9(2,5-11)7(14)8(15)10-4-3-6(12)13/h3-4,7,11,14H,5H2,1-2H3,(H,10,15)(H,12,13)/b4-3+/t7-/m0/s1
UniProtKB/TrEMBL

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 1.40E+4n/an/an/an/an/an/a



The Australian National University

Curated by ChEMBL


Assay Description
Inhibition of pantothenate kinase in Plasmodium falciparum 3D7 trophozoites using [14C]pantothenate as substrate after 15 mins by TopCount scintillat...


Eur J Med Chem 143: 1139-1147 (2018)


Article DOI: 10.1016/j.ejmech.2017.08.050
BindingDB Entry DOI: 10.7270/Q2FX7D11
More data for this
Ligand-Target Pair