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BDBM50513861 CHEMBL4549336

SMILES: OS(=O)(=O)c1cc(Cl)c(Cl)cc1Oc1ccc(Cl)cc1NC(=O)Nc1ccc(Cl)c(Cl)c1

InChI Key: InChIKey=JHTYLLPZYIYIOH-UHFFFAOYSA-N

Data: 1 KI

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50513861   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kcal/mole		IC50
nM		Kd
nM		EC50/IC50
nM		koff
s-1		kon
M-1s-1		pHTemp
°C
Plasmepsin 2


(Plasmodium falciparum)		BDBM50513861
PNG
(CHEMBL4549336)
Show SMILES OS(=O)(=O)c1cc(Cl)c(Cl)cc1Oc1ccc(Cl)cc1NC(=O)Nc1ccc(Cl)c(Cl)c1
Show InChI InChI=1S/C19H11Cl5N2O5S/c20-9-1-4-16(31-17-7-13(23)14(24)8-18(17)32(28,29)30)15(5-9)26-19(27)25-10-2-3-11(21)12(22)6-10/h1-8H,(H2,25,26,27)(H,28,29,30)
PDB
MMDB

KEGG

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UniProtKB/TrEMBL

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PC cid
PC sid
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Article
PubMed
 50n/an/an/an/an/an/an/an/a



Latvian Institute of Organic Synthesis

Curated by ChEMBL


Assay Description
Inhibition of Plasmodium falciparum plasmepsin 2 incubated for 10 mins followed by DABCYL-Glu-Arg-Nle-Phe-Leu-Ser-Phe-Pro-EDANS addition and measured...

J Med Chem 62: 8931-8950 (2019)


Article DOI: 10.1021/acs.jmedchem.9b00184
More data for this
Ligand-Target Pair