BDBM50206257 CHEMBL387584::CHEMBL450482::halisulfate 1::sodium (2R,3R)-9-(2,5-dihydroxyphenyl)-3,7-dimethyl-1-((1S,4aS,8aS)-2,5,5,8a-tetramethyl-1,4,4a,5,6,7,8,8a-octahydronaphthalen-1-yl)non-7-en-2-yl sulfate

SMILES C[C@H](CCC\C(C)=C\Cc1cc(O)ccc1O)[C@@H](C[C@H]1C(C)=CC[C@H]2C(C)(C)CCC[C@]12C)OS([O-])(=O)=O

InChI Key InChIKey=VCFONRYZIFVUGC-JWMGXGOZSA-M

Data  6 IC50

  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 6 hits for monomerid = 50206257   

TargetSortase family protein(Staphylococcus aureus)
Seoul National University

Curated by ChEMBL
LigandPNGBDBM50206257(CHEMBL387584 | CHEMBL450482 | halisulfate 1 | sodi...)
Affinity DataIC50:  3.60E+4nMAssay Description:Inhibition of recombinant Staphylococcus aureus ATCC 6538p sortase lacking the N-terminal membrane anchor domain expressed in Escherichia coli cells ...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetIsocitrate lyase(Candida albicans)
Seoul National University

Curated by ChEMBL
LigandPNGBDBM50206257(CHEMBL387584 | CHEMBL450482 | halisulfate 1 | sodi...)
Affinity DataIC50:  1.90E+4nMAssay Description:Inhibition of Candida albicans isocitrate lyaseMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetIsocitrate lyase(Candida albicans)
Seoul National University

Curated by ChEMBL
LigandPNGBDBM50206257(CHEMBL387584 | CHEMBL450482 | halisulfate 1 | sodi...)
Affinity DataIC50:  1.58E+5nMAssay Description:Inhibition of candida albicans isocitrate lyaseMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetPolyunsaturated fatty acid lipoxygenase ALOX15(Homo sapiens (Human))
University Of California Santa Cruz

Curated by ChEMBL
LigandPNGBDBM50206257(CHEMBL387584 | CHEMBL450482 | halisulfate 1 | sodi...)
Affinity DataIC50:  900nMAssay Description:Inhibition of His-tagged human reticulocyte 15-lipoxygenaseMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetIsocitrate lyase(Candida albicans)
Seoul National University

Curated by ChEMBL
LigandPNGBDBM50206257(CHEMBL387584 | CHEMBL450482 | halisulfate 1 | sodi...)
Affinity DataIC50:  7.02E+4nMAssay Description:Inhibition of candida albicans isocitrate lyaseMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetIsocitrate lyase(Magnaporthe oryzae (strain 70-15 / FGSC 8958) (Ric...)
Korea Ocean Research And Development Institute

Curated by ChEMBL
LigandPNGBDBM50206257(CHEMBL387584 | CHEMBL450482 | halisulfate 1 | sodi...)
Affinity DataIC50:  1.26E+4nMAssay Description:Inhibition of Magnaporthe grisea Guy 11 isocitrate lyaseMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed