BDBM562067 US11396516, Example 2

SMILES CC(C)(C)OC(=O)NCCCOc1c2ccoc2cc2oc(=O)ccc12

InChI Key InChIKey=PVEXJCCCVUMMDQ-UHFFFAOYSA-N

Data  5 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 5 hits for monomerid = 562067   

TargetCYP1A(Human)
The General Hospital

US Patent
LigandPNGBDBM562067(US11396516, Example 2)
Affinity DataIC50: 1.60E+3nMAssay Description:The ability of the tested compounds to inhibit a panel of CYP enzymes in vitro was assessed using a series of human liver microsome assays. Half-maxi...More data for this Ligand-Target Pair
In Depth
Date in BDB:
10/17/2022
Entry Details
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TargetCytochrome P450 2B6(Human)
The General Hospital

US Patent
LigandPNGBDBM562067(US11396516, Example 2)
Affinity DataIC50: 8.80E+4nMAssay Description:The ability of the tested compounds to inhibit a panel of CYP enzymes in vitro was assessed using a series of human liver microsome assays. Half-maxi...More data for this Ligand-Target Pair
In Depth
Date in BDB:
10/17/2022
Entry Details
Go to US Patent

TargetCytochrome P450 2C19(Human)
The General Hospital

US Patent
LigandPNGBDBM562067(US11396516, Example 2)
Affinity DataIC50: 1.20E+4nMAssay Description:The ability of the tested compounds to inhibit a panel of CYP enzymes in vitro was assessed using a series of human liver microsome assays. Half-maxi...More data for this Ligand-Target Pair
In Depth
Date in BDB:
10/17/2022
Entry Details
Go to US Patent

TargetCytochrome P450 2D6(Human)
The General Hospital

US Patent
LigandPNGBDBM562067(US11396516, Example 2)
Affinity DataIC50: 2.00E+3nMAssay Description:The ability of the tested compounds to inhibit a panel of CYP enzymes in vitro was assessed using a series of human liver microsome assays. Half-maxi...More data for this Ligand-Target Pair
In Depth
Date in BDB:
10/17/2022
Entry Details
Go to US Patent

TargetCytochrome P450 3A43(Human)
The General Hospital

US Patent
LigandPNGBDBM562067(US11396516, Example 2)
Affinity DataIC50: 9.30E+3nMAssay Description:The ability of the tested compounds to inhibit a panel of CYP enzymes in vitro was assessed using a series of human liver microsome assays. Half-maxi...More data for this Ligand-Target Pair
In Depth
Date in BDB:
10/17/2022
Entry Details
Go to US Patent