BDBM50221404 CHEMBL392270::neodysidenin

SMILES C[C@@H](C[C@H](NC(=O)C[C@H](C)C(Cl)(Cl)Cl)C(=O)N(C)[C@H](C)c1nccs1)C(Cl)(Cl)Cl

InChI Key InChIKey=MBVQTLXBQHZLRO-UHFFFAOYSA-N

Data  2 KI  2 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 50221404   

TargetPolyunsaturated fatty acid lipoxygenase ALOX15(Human)
University of California

Curated by ChEMBL
LigandPNGBDBM50221404(neodysidenin | CHEMBL392270)
Affinity DataIC50: 5.00E+5nMAssay Description:Inhibition of human 15-hLO1More data for this Ligand-Target Pair
In Depth
Date in BDB:
12/12/2012
Entry Details Article
PubMed
TargetPolyunsaturated fatty acid lipoxygenase ALOX12(Human)
University of California

Curated by ChEMBL
LigandPNGBDBM50221404(neodysidenin | CHEMBL392270)
Affinity DataIC50: 1.00E+5nMAssay Description:Inhibition of human 12-hLOMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/12/2012
Entry Details Article
PubMed
TargetPolyunsaturated fatty acid lipoxygenase ALOX12(Human)
University of California

Curated by ChEMBL
LigandPNGBDBM50221404(neodysidenin | CHEMBL392270)
Affinity DataKi:  1.70E+4nMAssay Description:Inhibition of human 12-hLOMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/12/2012
Entry Details Article
PubMed
TargetPolyunsaturated fatty acid lipoxygenase ALOX15(Human)
University of California

Curated by ChEMBL
LigandPNGBDBM50221404(neodysidenin | CHEMBL392270)
Affinity DataKi: >5.00E+5nMAssay Description:Inhibition of human 15-hLO1More data for this Ligand-Target Pair
In Depth
Date in BDB:
12/12/2012
Entry Details Article
PubMed