BDBM50576970 CHEMBL4863066

SMILES C[C@]12CC[C@H]3[C@@H]([C@H](C/C=C/C[C@@H]4CC5=CC(=O)CC[C@]5(C)[C@H]5CC[C@]6(C)[C@@H](O)CC[C@H]6[C@H]45)CC4=CC(=O)CC[C@@]43C)[C@@H]1CC[C@@H]2O

InChI Key InChIKey=FKJMMUCCAVJSJW-UHFFFAOYSA-N

Data  1 IC50  1 Kd

  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 2 hits for monomerid = 50576970   

TargetCytochrome P450 3A4(Human)
University of Quebec at Trois-Rivieres

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50576970BDBM50576970(CHEMBL4863066)
Affinity DataIC50: 6.50E+3nMAssay Description:Inhibition of recombinant human CYP3A4 using BFC as substrateMore data for this Ligand-Target Pair
In Depth
Date in BDB:
8/24/2022
Entry Details Article
PubMed
TargetCytochrome P450 3A4(Human)
University of Quebec at Trois-Rivieres

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50576970BDBM50576970(CHEMBL4863066)
Affinity DataKd:  7.10E+3nMAssay Description:Inhibition of human CYP3A4 assessed as dissociation constantMore data for this Ligand-Target Pair
In Depth
Date in BDB:
8/24/2022
Entry Details Article
PubMed