BDBM50221403 CHEMBL397803::mischellamine B

SMILES COc1cc(C)cc2c(cc(c(O)c12)-c1ccc2c(c(C)cc(OC)c2c1O)-c1c(O)cc(O)c2[C@@H](C)N[C@H](C)Cc12)-c1c(O)cc(O)c2[C@@H](C)N[C@H](C)Cc12

InChI Key InChIKey=BWZFGUKJQQFBKY-UHFFFAOYSA-N

Data  3 IC50

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

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50221403   

TargetPolyunsaturated fatty acid lipoxygenase ALOX12(Human)
University of California

Curated by ChEMBL
LigandPNGBDBM50221403(mischellamine B | CHEMBL397803)
Affinity DataIC50: 4.90E+3nMAssay Description:Inhibition of human 12-hLOMore data for this Ligand-Target Pair
In DepthDetails Article
PubMed
TargetPolyunsaturated fatty acid lipoxygenase ALOX15(Human)
University of California

Curated by ChEMBL
LigandPNGBDBM50221403(mischellamine B | CHEMBL397803)
Affinity DataIC50: 5.00E+4nMAssay Description:Inhibition of human 15-hLO2More data for this Ligand-Target Pair
In DepthDetails Article
PubMed
TargetPolyunsaturated fatty acid lipoxygenase ALOX15(Human)
University of California

Curated by ChEMBL
LigandPNGBDBM50221403(mischellamine B | CHEMBL397803)
Affinity DataIC50: 7.60E+3nMAssay Description:Inhibition of human 15-hLO1More data for this Ligand-Target Pair
In DepthDetails Article
PubMed