BDBM41957 3-(3,4-dihydroxyphenyl)propanoic acid::3-(3,4-dihydroxyphenyl)propionic acid::3-[3,4-bis(oxidanyl)phenyl]propanoic acid::US20240415800, Compound 2-8::cid_348154

SMILES OC(=O)CCc1ccc(O)c(O)c1

InChI Key InChIKey=DZAUWHJDUNRCTF-UHFFFAOYSA-N

Data  1 KI  4 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 = 41957   

TargetMothers against decapentaplegic homolog 3(Human)
Emory University

Curated by PubChem BioAssay
LigandPNGBDBM41957(3-[3,4-bis(oxidanyl)phenyl]propanoic acid | 3-(3,4...)
Affinity DataIC50: 5.00E+4nMAssay Description:NIH Molecular Libraries Screening Centers Network [MLSCN] Emory Chemical Biology Discovery Center in MLSCN Assay provider: F.M. Hoffmann, University ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
5/17/2011
Entry Details
PCBioAssay
Target3-oxoacyl-ACP synthase(Pseudomonas aeruginosa)
Institute For Pharmaceutical Research Saarland (Hips)

Curated by ChEMBL
LigandPNGBDBM41957(3-[3,4-bis(oxidanyl)phenyl]propanoic acid | 3-(3,4...)
Affinity DataIC50: 2.70E+4nMAssay Description:Inhibition of Pseudomonas aeruginosa recombinant PqsD expressed in Escherichia coli BL21 (lambdaDE3) using ACoA/beta-ketodecanoic acid as substrate a...More data for this Ligand-Target Pair
In Depth
Date in BDB:
4/4/2016
Entry Details Article
PubMed
TargetAnthrax toxin receptor 2(Human)
Harvard Medical School

Curated by ChEMBL
LigandPNGBDBM41957(3-[3,4-bis(oxidanyl)phenyl]propanoic acid | 3-(3,4...)
Affinity DataIC50: 3.00E+5nMAssay Description:Inhibition of CMG2 (40 to 217) C175A and R40C double mutant (unknown origin) interaction to full length PA E733C mutant expressed in Escherichia coli...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/31/2020
Entry Details Article
PubMed
TargetGlutamate carboxypeptidase 2(Human)
The Johns Hopkins University

US Patent
LigandPNGBDBM41957(3-[3,4-bis(oxidanyl)phenyl]propanoic acid | 3-(3,4...)
Affinity DataIC50: 4.00E+3nMAssay Description:Inhibition potencies against GCPII (IC50 values) were determined using previously described methods with minor modification. Rojas et al., 2002. Brie...More data for this Ligand-Target Pair
In Depth
Date in BDB:
5/1/2025
Entry Details
Go to US Patent

TargetProlyl 4-hydroxylase subunit alpha-1(Chicken)
University of Oulu

LigandPNGBDBM41957(3-[3,4-bis(oxidanyl)phenyl]propanoic acid | 3-(3,4...)
Affinity DataKi:  1.30E+4nMAssay Description:Inhibition assay using procollagen-prolin, 2-oxoglutarate 4-dioxygenase.More data for this Ligand-Target Pair
In Depth
Date in BDB:
1/21/2013
Entry Details
PubMed