BDBM50271143 (3R,4R)-(-)-6-methoxy-1-oxo-3-pentyl-3,4-dihydro-1H-isochromen-4-yl acetate::CHEMBL529220

SMILES CCCCC[C@H]1OC(=O)c2ccc(OC)cc2[C@H]1OC(C)=O

InChI Key InChIKey=XFZDFYYRUDDKBS-UHFFFAOYSA-N

Data  3 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
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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 = 50271143   

TargetCytochrome P450 1A1(Human)
Universidade Federal De Minas Gerais

Curated by ChEMBL
LigandPNGBDBM50271143((3R,4R)-(-)-6-methoxy-1-oxo-3-pentyl-3,4-dihydro-1...)
Affinity DataIC50: 3.80E+4nMAssay Description:Inhibition of CYP1A1More data for this Ligand-Target Pair
In Depth
Date in BDB:
12/17/2012
Entry Details Article
PubMed
TargetCytochrome P450 2C8(Human)
Universidade Federal De Minas Gerais

Curated by ChEMBL
LigandPNGBDBM50271143((3R,4R)-(-)-6-methoxy-1-oxo-3-pentyl-3,4-dihydro-1...)
Affinity DataIC50: 6.50E+4nMAssay Description:Inhibition of CYP2C8More data for this Ligand-Target Pair
In Depth
Date in BDB:
12/17/2012
Entry Details Article
PubMed
TargetCytochrome P450 3A4(Human)
Universidade Federal De Minas Gerais

Curated by ChEMBL
LigandPNGBDBM50271143((3R,4R)-(-)-6-methoxy-1-oxo-3-pentyl-3,4-dihydro-1...)
Affinity DataIC50: 6.50E+4nMAssay Description:Inhibition of CYP3A4More data for this Ligand-Target Pair
In Depth
Date in BDB:
12/17/2012
Entry Details Article
PubMed