BDBM54446 7-hydroxy-8-methyl-4-phenyl-1-benzopyran-2-one::7-hydroxy-8-methyl-4-phenyl-2H-chromen-2-one::7-hydroxy-8-methyl-4-phenyl-coumarin::7-hydroxy-8-methyl-4-phenylchromen-2-one::8-methyl-7-oxidanyl-4-phenyl-chromen-2-one::MLS001197424::SMR000555337::cid_5336569

SMILES Cc1c(O)ccc2c(cc(=O)oc12)-c1ccccc1

InChI Key InChIKey=ZRMUHRWNDDQVEX-UHFFFAOYSA-N

Data  4 KI  5 IC50  2 EC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
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Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 11 hits for monomerid = 54446   

TargetNucleotide-binding oligomerization domain-containing protein 2(Human)
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM54446(7-hydroxy-8-methyl-4-phenyl-1-benzopyran-2-one | c...)
Affinity DataIC50: 6.85E+3nMAssay Description:Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...More data for this Ligand-Target Pair
In Depth
Date in BDB:
6/5/2011
Entry Details
PCBioAssay
TargetNucleotide-binding oligomerization domain-containing protein 1(Human)
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM54446(7-hydroxy-8-methyl-4-phenyl-1-benzopyran-2-one | c...)
Affinity DataEC50:  1.63E+4nMAssay Description:Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...More data for this Ligand-Target Pair
In Depth
Date in BDB:
7/8/2011
Entry Details
PCBioAssay
TargetTumor necrosis factor(Human)
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM54446(7-hydroxy-8-methyl-4-phenyl-1-benzopyran-2-one | c...)
Affinity DataIC50: 5.78E+3nMAssay Description:Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...More data for this Ligand-Target Pair
In Depth
Date in BDB:
7/11/2011
Entry Details
PCBioAssay
TargetNucleotide-binding oligomerization domain-containing protein 1(Human)
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM54446(7-hydroxy-8-methyl-4-phenyl-1-benzopyran-2-one | c...)
Affinity DataIC50: 6.53E+3nMAssay Description:Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...More data for this Ligand-Target Pair
In Depth
Date in BDB:
7/9/2011
Entry Details
PCBioAssay
TargetTumor necrosis factor(Human)
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM54446(7-hydroxy-8-methyl-4-phenyl-1-benzopyran-2-one | c...)
Affinity DataIC50: 6.62E+3nMAssay Description:Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...More data for this Ligand-Target Pair
In Depth
Date in BDB:
7/9/2011
Entry Details
PCBioAssay
TargetGlycogen synthase kinase-3 beta(Human)
Broad Institute

Curated by PubChem BioAssay
LigandPNGBDBM54446(7-hydroxy-8-methyl-4-phenyl-1-benzopyran-2-one | c...)
Affinity DataEC50: >3.00E+5nMAssay Description:Keywords: GSK3beta, dose response, kinase, inhibition, HTS Assay Overview: The glycogen synthase kinase-3 beta (GSK-3b) is a known master regulator f...More data for this Ligand-Target Pair
In Depth
Date in BDB:
7/29/2011
Entry Details
PCBioAssay
TargetMitochondrial peptide methionine sulfoxide reductase(Bovine)
The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay
LigandPNGBDBM54446(7-hydroxy-8-methyl-4-phenyl-1-benzopyran-2-one | c...)
Affinity DataIC50: 1.55E+5nMMore data for this Ligand-Target Pair
In Depth
Date in BDB:
6/21/2013
Entry Details
PCBioAssay
TargetCarbonic anhydrase 9(Human)
University of Messina

Curated by ChEMBL
LigandPNGBDBM54446(7-hydroxy-8-methyl-4-phenyl-1-benzopyran-2-one | c...)
Affinity DataKi:  40nMAssay Description:Inhibition of human carbonic anhydrase 9 incubated for 15 mins prior to testing by stopped-flow CO2 hydration assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
7/11/2020
Entry Details Article
PubMed
TargetCarbonic anhydrase 12(Human)
University of Messina

Curated by ChEMBL
LigandPNGBDBM54446(7-hydroxy-8-methyl-4-phenyl-1-benzopyran-2-one | c...)
Affinity DataKi:  402nMAssay Description:Inhibition of human carbonic anhydrase 12 incubated for 15 mins prior to testing by stopped-flow CO2 hydration assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
7/11/2020
Entry Details Article
PubMed
TargetCarbonic anhydrase 2(Human)
University of Messina

Curated by ChEMBL
LigandPNGBDBM54446(7-hydroxy-8-methyl-4-phenyl-1-benzopyran-2-one | c...)
Affinity DataKi: >1.00E+4nMAssay Description:Inhibition of human carbonic anhydrase 2 incubated for 15 mins prior to testing by stopped-flow CO2 hydration assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
7/11/2020
Entry Details Article
PubMed
TargetCarbonic anhydrase 1(Human)
University of Messina

Curated by ChEMBL
LigandPNGBDBM54446(7-hydroxy-8-methyl-4-phenyl-1-benzopyran-2-one | c...)
Affinity DataKi: >1.00E+4nMAssay Description:Inhibition of human carbonic anhydrase 1 incubated for 15 mins prior to testing by stopped-flow CO2 hydration assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
7/11/2020
Entry Details Article
PubMed