BDBM50301838 4-((2-(3-methyl-1,2-dioxaspiro[4.5]decan-3-yl)acetamido)methyl)benzoic acid::CHEMBL577470

SMILES CC1(CC(=O)NCc2ccc(cc2)C(O)=O)CC2(CCCCC2)OO1

InChI Key InChIKey=PVSATFACFVIGLJ-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 = 50301838   

TargetCytochrome P450 1A2(Homo sapiens (Human))
Institute Infectious Diseases Initiative

Curated by ChEMBL
LigandPNGBDBM50301838(4-((2-(3-methyl-1,2-dioxaspiro[4.5]decan-3-yl)acet...)
Affinity DataIC50: >5.00E+3nMAssay Description:Inhibition of human CYP1A2More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCytochrome P450 2C9(Homo sapiens (Human))
Institute Infectious Diseases Initiative

Curated by ChEMBL
LigandPNGBDBM50301838(4-((2-(3-methyl-1,2-dioxaspiro[4.5]decan-3-yl)acet...)
Affinity DataIC50: >5.00E+3nMAssay Description:Inhibition of human CYP2C9More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCytochrome P450 2D6(Homo sapiens (Human))
Institute Infectious Diseases Initiative

Curated by ChEMBL
LigandPNGBDBM50301838(4-((2-(3-methyl-1,2-dioxaspiro[4.5]decan-3-yl)acet...)
Affinity DataIC50: >5.00E+3nMAssay Description:Inhibition of human CYP2D6More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCytochrome P450 3A4(Homo sapiens (Human))
Institute Infectious Diseases Initiative

Curated by ChEMBL
LigandPNGBDBM50301838(4-((2-(3-methyl-1,2-dioxaspiro[4.5]decan-3-yl)acet...)
Affinity DataIC50: >5.00E+3nMAssay Description:Inhibition of human CYP3A4More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCytochrome P450 2C19(Homo sapiens (Human))
Institute Infectious Diseases Initiative

Curated by ChEMBL
LigandPNGBDBM50301838(4-((2-(3-methyl-1,2-dioxaspiro[4.5]decan-3-yl)acet...)
Affinity DataIC50: >5.00E+3nMAssay Description:Inhibition of human CYP2C19More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed