BDBM50173751 (1R,2R,3R,4R)-1,4-Bis-((E)-3-bromo-allyloxy)-1,4-bis-(5-methyl-[1,3,4]oxadiazol-2-yl)-butane-2,3-diol::CHEMBL198767

SMILES Cc1nnc(o1)[C@H](OC\C=C\Br)[C@H](O)[C@@H](O)[C@@H](OC\C=C\Br)c1nnc(C)o1

InChI Key InChIKey=QYOVCNSGTFDHIB-UHFFFAOYSA-N

Data  3 KI

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50173751   

TargetPlasmepsin I(malaria parasite P. falciparum)
Uppsala University

Curated by ChEMBL
LigandPNGBDBM50173751((1R,2R,3R,4R)-1,4-Bis-((E)-3-bromo-allyloxy)-1,4-b...)
Affinity DataKi: >3.00E+3nMAssay Description:Inhibition constant against plasmepsin-1 of Plasmodium falciparum, 10 min using 3 uM of DABCYL-Glu-Arg-Nle-Phe-Le u-Ser-Phe-Pro-EDANS as substrateMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetPlasmepsin II(Plasmodium falciparum)
Uppsala University

Curated by ChEMBL
LigandPNGBDBM50173751((1R,2R,3R,4R)-1,4-Bis-((E)-3-bromo-allyloxy)-1,4-b...)
Affinity DataKi: >5.00E+3nMAssay Description:Inhibition constant against plasmepsin-2 of Plasmodium falciparum 10 min using 3 uM of DABCYL-Glu-Arg-Nle-Phe-Le u-Ser-Phe-Pro-EDANS as substrateMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetCathepsin D(Human)
Uppsala University

Curated by ChEMBL
LigandPNGBDBM50173751((1R,2R,3R,4R)-1,4-Bis-((E)-3-bromo-allyloxy)-1,4-b...)
Affinity DataKi: >6.00E+3nMpH: 4.5Assay Description:Inhibition constant against pro-cathepsin D (50 ng/mL) of human liver upon incubation at pH 4.5 for 10 min using DABCYL-Glu-Arg-Nle-Phe-Le u-Ser-Phe-...More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed