BDBM50205152 CHEMBL3984859

SMILES [H][C@]12CCC[C@@]1([H])N([C@H](CO2)C1(CC(=O)N2CC[C@@H](CO)C2)CC1)S(=O)(=O)c1ccc(Cl)cc1

InChI Key InChIKey=LMVCUWRFZAVJPD-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 = 50205152   

TargetCytochrome P450 3A4(Human)
Merck Research Laboratories

Curated by ChEMBL
LigandPNGBDBM50205152(CHEMBL3984859)
Affinity DataIC50: 3.00E+4nMAssay 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
LigandPNGBDBM50205152(CHEMBL3984859)
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