BDBM50205194 CHEMBL3976597

SMILES CC(C)(CO)N1CCN(CC1)C(=O)CC1(CC1)[C@H]1COC[C@@H](C2CC2)N1S(=O)(=O)c1ccc(Cl)cc1

InChI Key InChIKey=PCDQBKQXBRQUPC-UHFFFAOYSA-N

Data  2 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50205194   

TargetCytochrome P450 3A4(Human)
Merck Research Laboratories

Curated by ChEMBL
LigandPNGBDBM50205194(CHEMBL3976597)
Affinity DataIC50: 1.90E+3nMAssay Description:Inhibition of recombinant human CYP3A4 expressed in baculovirus infected insect cells preincubated for 30 mins using fluorescent substrateMore data for this Ligand-Target Pair
In Depth
Date in BDB:
8/18/2018
Entry Details Article
PubMed
TargetCytochrome P450 3A4(Human)
Merck Research Laboratories

Curated by ChEMBL
LigandPNGBDBM50205194(CHEMBL3976597)
Affinity DataIC50: 3.00E+4nMAssay Description:Inhibition of recombinant human CYP3A4 expressed in baculovirus infected insect cells using fluorescent substrateMore data for this Ligand-Target Pair
In Depth
Date in BDB:
8/18/2018
Entry Details Article
PubMed