BDBM29221 casimiroin analogue, 1j

SMILES COc1cc(OC)c2n(C)c(=O)cc(C)c2c1

InChI Key InChIKey=BYYQQWLTZFBHIQ-UHFFFAOYSA-N

Data  2 IC50

PDB links: 1 PDB ID matches this monomer.

  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 2 hits for monomerid = 29221   

LigandPNGBDBM29221(casimiroin analogue, 1j)
Affinity DataIC50: 1.90E+3nMpH: 7.5 T: 2°CAssay Description:The activity of QR2 under steady-state conditions was evaluated on SpectraMax Plus 384 UV/vis spectrophotometer by monitoring the increase in absorba...More data for this Ligand-Target Pair
In DepthDetails Article
PubMedPDB3D3D Structure (crystal)
TargetAromatase(Human)
Purdue University

LigandPNGBDBM29221(casimiroin analogue, 1j)
Affinity DataIC50: 960nMAssay Description:The activity of QR2 under steady-state conditions was evaluated on SpectraMax Plus 384 UV/vis spectrophotometer by monitoring the increase in absorba...More data for this Ligand-Target Pair
In DepthDetails Article
PubMed