BDBM92556 Neoflavonoid, 8

SMILES COc1cc(cc(OC)c1O)C1CC(=O)Oc2cc3OCOc3cc12

InChI Key InChIKey=VNKHCWQSLKFNQA-UHFFFAOYSA-N

Data  1 KI  3 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 92556   

TargetAromatase(Human)
American University of Ras Al Khaimah

Curated by ChEMBL
LigandPNGBDBM92556(Neoflavonoid, 8)
Affinity DataIC50: 1.21E+4nMAssay Description:Inhibition of aromatase (unknown origin) after 30 mins by fluorescence assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/8/2016
Entry Details Article
PubMed
TargetAromatase(Human)
American University of Ras Al Khaimah

Curated by ChEMBL
LigandPNGBDBM92556(Neoflavonoid, 8)
Affinity DataIC50: 1.21E+4nMAssay Description:Inhibition of aromatase (unknown origin) preincubated for 10 mins in presence of NADPH generating system followed by addition of dibenzylfluorescein ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
10/9/2017
Entry Details Article
PubMed
TargetAromatase(Human)
American University of Ras Al Khaimah

Curated by ChEMBL
LigandPNGBDBM92556(Neoflavonoid, 8)
Affinity DataKi:  0.00182nM IC50: 1.21E+4nMAssay Description:Inhibition assay using aromatase enzyme.More data for this Ligand-Target Pair
In Depth
Date in BDB:
10/29/2012
Entry Details Article
PubMed