BDBM50503767 CHEMBL4547387

SMILES CC(=O)S[C@H]1CC[C@H](c2cc(=O)c3ccc4ccccc4c3o2)CC1

InChI Key InChIKey=FUWOOYFXEWDHNG-UHFFFAOYSA-N

Data  3 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50503767   

TargetCytochrome P450 1A1(Human)
Showa Pharmaceutical University

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50503767BDBM50503767(CHEMBL4547387)
Affinity DataIC50: 16nMAssay Description:Inhibition of human recombinant CYP1A1 using 7-ethoxyresorufin as substrate after 15 mins in presence of NADPH by EROD assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
2/18/2021
Entry Details Article
PubMed
TargetCytochrome P450 1B1(Human)
Showa Pharmaceutical University

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50503767BDBM50503767(CHEMBL4547387)
Affinity DataIC50: 29nMAssay Description:Inhibition of human recombinant CYP1B1 using 7-ethoxyresorufin as substrate after 30 mins in presence of NADPH by EROD assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
2/18/2021
Entry Details Article
PubMed
TargetCytochrome P450 1A2(Human)
Showa Pharmaceutical University

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50503767BDBM50503767(CHEMBL4547387)
Affinity DataIC50: 991nMAssay Description:Inhibition of human recombinant CYP1A2 using 7-ethoxyresorufin as substrate after 30 mins in presence of NADPH by EROD assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
2/18/2021
Entry Details Article
PubMed