BDBM50301836 CHEMBL565362::N-(4-bromo-2-fluorobenzyl)-2-(3-methyl-1,2-dioxaspiro[4.5]decan-3-yl)acetamide

SMILES CC1(CC(=O)NCc2ccc(Br)cc2F)CC2(CCCCC2)OO1

InChI Key InChIKey=KJBIXUOGFIZTTB-UHFFFAOYSA-N

Data  5 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 5 hits for monomerid = 50301836   

TargetCytochrome P450 1A2(Human)
Institute Infectious Diseases Initiative

Curated by ChEMBL
LigandPNGBDBM50301836(N-(4-bromo-2-fluorobenzyl)-2-(3-methyl-1,2-dioxasp...)
Affinity DataIC50: 5.00E+3nMAssay Description:Inhibition of human CYP1A2More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/30/2010
Entry Details Article
PubMed
TargetCytochrome P450 2C9(Human)
Institute Infectious Diseases Initiative

Curated by ChEMBL
LigandPNGBDBM50301836(N-(4-bromo-2-fluorobenzyl)-2-(3-methyl-1,2-dioxasp...)
Affinity DataIC50: 3.90E+3nMAssay Description:Inhibition of human CYP2C9More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/30/2010
Entry Details Article
PubMed
TargetCytochrome P450 2C19(Human)
Institute Infectious Diseases Initiative

Curated by ChEMBL
LigandPNGBDBM50301836(N-(4-bromo-2-fluorobenzyl)-2-(3-methyl-1,2-dioxasp...)
Affinity DataIC50: 2.80E+3nMAssay Description:Inhibition of human CYP2C19More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/30/2010
Entry Details Article
PubMed
TargetCytochrome P450 3A4(Human)
Institute Infectious Diseases Initiative

Curated by ChEMBL
LigandPNGBDBM50301836(N-(4-bromo-2-fluorobenzyl)-2-(3-methyl-1,2-dioxasp...)
Affinity DataIC50: 4.40E+3nMAssay Description:Inhibition of human CYP3A4More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/30/2010
Entry Details Article
PubMed
TargetCytochrome P450 2D6(Human)
Institute Infectious Diseases Initiative

Curated by ChEMBL
LigandPNGBDBM50301836(N-(4-bromo-2-fluorobenzyl)-2-(3-methyl-1,2-dioxasp...)
Affinity DataIC50: 5.00E+3nMAssay Description:Inhibition of human CYP2D6More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/30/2010
Entry Details Article
PubMed