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SMILES O[C@@H]1[C@H]2COC(=O)c3cc(O)c(O)c(O)c3-c3c(O)c(O)c(O)cc3C(=O)O[C@@H]1[C@@H](O)[C@H](OC(=O)c1cc(O)c(O)c(O)c1)O2

InChI Key InChIKey=TUSDEZXZIZRFGC-XIGLUPEJSA-N

  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 6 hits for monomerid = 50242279   

TargetSqualene monooxygenase(Rattus norvegicus)
University of Shizuoka

Curated by ChEMBL
LigandPNGBDBM50242279(6,7,8,11,12,13,22,23-octahydroxy-3,16-dioxo-21-(3,...)copy SMILEScopy InChI
Affinity DataIC50: 4.00E+3nMAssay Description:Inhibition of C-terminal hexahistidine-tagged rat recombinant squalene epoxidase without N-terminal putative membrane domain expressed in Escherichia...More data for this Ligand-Target Pair
In DepthDetails
BindingDB Entry DOI: 10.7270/Q25Q4X03PubMed
TargetAngiotensin-converting enzyme(Homo sapiens (Human))
TBA

Curated by ChEMBL
LigandPNGBDBM50242279(6,7,8,11,12,13,22,23-octahydroxy-3,16-dioxo-21-(3,...)copy SMILEScopy InChI
Affinity DataIC50: 3.70E+6nMAssay Description:Inhibition of ACE by fluorometric assayMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2XW4M1CPubMed
TargetAmyloid-beta precursor protein(Homo sapiens (Human))TBA
LigandPNGBDBM50242279(6,7,8,11,12,13,22,23-octahydroxy-3,16-dioxo-21-(3,...)copy SMILEScopy InChI
Affinity DataEC50:  8.90nMMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2H70KVXPubMed
LigandPNGBDBM50242279(6,7,8,11,12,13,22,23-octahydroxy-3,16-dioxo-21-(3,...)copy SMILEScopy InChI
Affinity DataIC50: 2.00E+4nMAssay Description:Inhibitory activity against protein kinase C (PKC)More data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2G44T0S
TargetAmyloid-beta precursor protein(Homo sapiens (Human))TBA
LigandPNGBDBM50242279(6,7,8,11,12,13,22,23-octahydroxy-3,16-dioxo-21-(3,...)copy SMILEScopy InChI
Affinity DataEC50:  3.20nMMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2H70KVXPubMed
TargetDNA topoisomerase 1(Homo sapiens (Human))
TBA

Curated by ChEMBL
LigandPNGBDBM50242279(6,7,8,11,12,13,22,23-octahydroxy-3,16-dioxo-21-(3,...)copy SMILEScopy InChI
Affinity DataIC50: 4.00E+4nMAssay Description:Inhibition of human COLO201 cellular topoisomerase-1 mediated plasmid DNA cleavage by electrophoresis in presence of 70 units of enzymeMore data for this Ligand-Target Pair
In DepthDetails Article
BindingDB Entry DOI: 10.7270/Q2542NNPPubMed