BDBM50236899 CHEMBL4099822

SMILES CCCc1c(C)c2cc3c(C)c(C)oc3cc2oc1=O

InChI Key InChIKey=ADGUVFJYVNRVPX-UHFFFAOYSA-N

Data  1 KI  7 IC50

PDB links: 1 PDB ID matches this monomer.

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Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 8 hits for monomerid = 50236899   

TargetAldehyde dehydrogenase family 1 member A3(Human)
Indiana University School of Medicine

Curated by ChEMBL
LigandPNGBDBM50236899(CHEMBL4099822)
Affinity DataIC50: 400nMAssay Description:Inhibition of full length recombinant human ALDH1A3 expressed in Escherichia coli BL21(DE3) assessed as reduction in dehydrogenase activity by measur...More data for this Ligand-Target Pair
In DepthDetails Article
PubMed
TargetAldehyde dehydrogenase X, mitochondrial(Human)
Indiana University School of Medicine

Curated by ChEMBL
LigandPNGBDBM50236899(CHEMBL4099822)
Affinity DataIC50: 360nMAssay Description:Inhibition of full length recombinant human ALDH1B1 expressed in Escherichia coli TunerDE3 assessed as reduction in dehydrogenase activity by measuri...More data for this Ligand-Target Pair
In DepthDetails Article
PubMed
TargetAldehyde dehydrogenase 1A1(Human)
Indiana University School of Medicine

Curated by ChEMBL
LigandPNGBDBM50236899(CHEMBL4099822)
Affinity DataIC50: 220nMAssay Description:Inhibition of full length recombinant human ALDH1A1 expressed in Escherichia coli BL21(DE3) assessed as reduction in dehydrogenase activity by measur...More data for this Ligand-Target Pair
In DepthDetails Article
PubMed
TargetAldehyde dehydrogenase, mitochondrial(Human)
Indiana University School of Medicine

Curated by ChEMBL
LigandPNGBDBM50236899(CHEMBL4099822)
Affinity DataIC50: 110nMAssay Description:Inhibition of full length recombinant human ALDH2 expressed in Escherichia coli assessed as reduction in dehydrogenase activity by measuring NAD(P)H ...More data for this Ligand-Target Pair
In DepthDetails Article
PubMedPDB3D3D Structure (crystal)
TargetRetinal dehydrogenase 2(Human)
Indiana University School of Medicine

Curated by ChEMBL
LigandPNGBDBM50236899(CHEMBL4099822)
Affinity DataIC50: 300nMAssay Description:Inhibition of full length recombinant human ALDH1A2 expressed in Escherichia coli BL21(DE3) assessed as reduction in dehydrogenase activity by measur...More data for this Ligand-Target Pair
In DepthDetails Article
PubMed
TargetAldehyde dehydrogenase 1A1(Human)
Indiana University School of Medicine

Curated by ChEMBL
LigandPNGBDBM50236899(CHEMBL4099822)
Affinity DataIC50: 220nMAssay Description:Inhibition of human ALDH1A1More data for this Ligand-Target Pair
In DepthDetails
PubMed
TargetAldehyde dehydrogenase, mitochondrial(Human)
Indiana University School of Medicine

Curated by ChEMBL
LigandPNGBDBM50236899(CHEMBL4099822)
Affinity DataIC50: 110nMAssay Description:Inhibition of human ALDH2More data for this Ligand-Target Pair
In DepthDetails
PubMedPDB3D3D Structure (crystal)
TargetAldehyde dehydrogenase, mitochondrial(Human)
Indiana University School of Medicine

Curated by ChEMBL
LigandPNGBDBM50236899(CHEMBL4099822)
Affinity DataKi:  19nMAssay Description:Competitive inhibition of full length recombinant human ALDH2 expressed in Escherichia coli assessed as reduction in dehydrogenase activity using pro...More data for this Ligand-Target Pair
In DepthDetails Article
PubMedPDB3D3D Structure (crystal)