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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Plasmepsin V' and Ligand = 'BDBM50099241'   
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
Plasmepsin V


(Plasmodium falciparum (isolate 3D7))		BDBM50099241
PNG
(CHEMBL3344158)
Show SMILES OC(=O)C(F)(F)F.CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCCNC(N)=N)NC(=O)OCc1ccccc1)[C@@H](O)CC(=O)NC1CCCCC1 |r|
Show InChI InChI=1S/C32H53N7O6.C2HF3O2/c1-21(2)18-26(27(40)19-28(41)37-24-14-8-5-9-15-24)38-29(42)22(3)36-30(43)25(16-10-11-17-35-31(33)34)39-32(44)45-20-23-12-6-4-7-13-23;3-2(4,5)1(6)7/h4,6-7,12-13,21-22,24-27,40H,5,8-11,14-20H2,1-3H3,(H,36,43)(H,37,41)(H,38,42)(H,39,44)(H4,33,34,35);(H,6,7)/t22-,25-,26-,27-;/m0./s1
UniProtKB/TrEMBL

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PC sid
UniChem

Similars
Article
PubMed
n/an/a>2.00E+4n/an/an/an/an/an/a



The Walter and Eliza Hall Institute of Medical Research

Curated by ChEMBL


Assay Description
Inhibition of Plasmodium falciparum plasmepsin V assessed as cleavage of wtKAHRP fluorogenic substrate

J Med Chem 57: 7644-62 (2014)


Article DOI: 10.1021/jm500797g
BindingDB Entry DOI: 10.7270/Q2CR5W42
More data for this
Ligand-Target Pair