BDBM50503771 CHEMBL4476231

SMILES O=c1cc([C@H]2CC[C@H](S)CC2)oc2c1ccc1ccccc12

InChI Key InChIKey=HOFSLXFSYHAENV-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 = 50503771   

TargetCytochrome P450 1B1(Human)
Showa Pharmaceutical University

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50503771BDBM50503771(CHEMBL4476231)
Affinity DataIC50: 40nMAssay 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 1A1(Human)
Showa Pharmaceutical University

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50503771BDBM50503771(CHEMBL4476231)
Affinity DataIC50: 146nMAssay 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 1A2(Human)
Showa Pharmaceutical University

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50503771BDBM50503771(CHEMBL4476231)
Affinity DataIC50: 689nMAssay 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