BDBM209868 3-[18-(2-carboxyethyl)-8,13-bis(ethenyl)-3,7,12,17-tetramethylporphyrin-21,24-diid-2-yl]propanoic acid;iron(2+)::Haemin::Heme

SMILES Cc1c(C=C)c2cc3[n-]c(cc4[n-]c(cc5nc(cc1n2)c(C=C)c5C)c(C)c4CCC(O)=O)c(CCC(O)=O)c3C

InChI Key InChIKey=PRFMATRBBQRQBM-UJJXFSCMSA-L

Data  1 IC50  12 Kd

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 13 hits for monomerid = 209868   

TargetTspO-like protein(Fremyella diplosiphon (Cyanobacterium))
Michigan State University

LigandPNGBDBM209868(3-[18-(2-carboxyethyl)-8,13-bis(ethenyl)-3,7,12,17...)
Affinity DataKd:  1.91E+3nMAssay Description:Tryptophan fluorescence measurements were performed with purified FdTSPO1 protein and ligand essentially as described by Li et al.; 2.5 μM prote...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCoproheme decarboxylase(Staphylococcus aureus)
University Of Notre Dame

LigandPNGBDBM209868(3-[18-(2-carboxyethyl)-8,13-bis(ethenyl)-3,7,12,17...)
Affinity DataKd:  720nMpH: 6.8 T: 2°CAssay Description:All UV-visible spectra were measured on a Varian Cary 50 spectrometer with temperature control from a Peltier cooler. The holo-enzyme was titrated in...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetCoproheme decarboxylase(Staphylococcus aureus)
University Of Notre Dame

LigandPNGBDBM209868(3-[18-(2-carboxyethyl)-8,13-bis(ethenyl)-3,7,12,17...)
Affinity DataKd:  1.68E+3nMpH: 6.8Assay Description:Titrations using fluorescence spectroscopy were carried out on a Jobin Yvon Horiba FluoroMax-3 fluorimeter in scanning mode. Apo-HemQ (5 μM) was...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetDimer of Prostaglandin G/H synthase 2(Homo sapiens (Human))
University Of Michigan Medical School

LigandPNGBDBM209868(3-[18-(2-carboxyethyl)-8,13-bis(ethenyl)-3,7,12,17...)
Affinity DataKd:  130nMpH: 8.0Assay Description:POX reactions were conducted in 2 ml of filtered and degassed 50 mM Tris-HCl, pH 8.0, containing 50 mM NaCl, 0.1 mM H2O2, 4.5 mM guaiacol, and the in...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetProstaglandin G/H synthase 2(Homo sapiens (Human))
University Of Michigan Medical School

LigandPNGBDBM209868(3-[18-(2-carboxyethyl)-8,13-bis(ethenyl)-3,7,12,17...)
Affinity DataKd:  160nMpH: 8.0Assay Description:POX reactions were conducted in 2 ml of filtered and degassed 50 mM Tris-HCl, pH 8.0, containing 50 mM NaCl, 0.1 mM H2O2, 4.5 mM guaiacol, and the in...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetDimer of Prostaglandin G/H synthase 2 [Y385F](Homo sapiens (Human))
University Of Michigan Medical School

LigandPNGBDBM209868(3-[18-(2-carboxyethyl)-8,13-bis(ethenyl)-3,7,12,17...)
Affinity DataKd:  1.60E+3nMpH: 8.0Assay Description:POX reactions were conducted in 2 ml of filtered and degassed 50 mM Tris-HCl, pH 8.0, containing 50 mM NaCl, 0.1 mM H2O2, 4.5 mM guaiacol, and the in...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetGlutathione S-transferase P(Homo sapiens (Human))
University Of Zimbabwe

LigandPNGBDBM209868(3-[18-(2-carboxyethyl)-8,13-bis(ethenyl)-3,7,12,17...)
Affinity DataIC50:  4.00E+3nMAssay Description:A range of natural products were screened for inhibition of PfGST by GST assay with CDNB as a substrate, using a 96-well SpectraMax 340 microplate sp...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetProstaglandin G/H synthase 2 [R120A,Y385F](Homo sapiens (Human))
University Of Michigan Medical School

LigandPNGBDBM209868(3-[18-(2-carboxyethyl)-8,13-bis(ethenyl)-3,7,12,17...)
Affinity DataKd:  620nMpH: 8.0Assay Description:POX reactions were conducted in 2 ml of filtered and degassed 50 mM Tris-HCl, pH 8.0, containing 50 mM NaCl, 0.1 mM H2O2, 4.5 mM guaiacol, and the in...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetDimer of Prostaglandin G/H synthase 2 [R120Q](Homo sapiens (Human))
University Of Michigan Medical School

LigandPNGBDBM209868(3-[18-(2-carboxyethyl)-8,13-bis(ethenyl)-3,7,12,17...)
Affinity DataKd:  220nMpH: 8.0Assay Description:POX reactions were conducted in 2 ml of filtered and degassed 50 mM Tris-HCl, pH 8.0, containing 50 mM NaCl, 0.1 mM H2O2, 4.5 mM guaiacol, and the in...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetDimer of Prostaglandin G/H synthase 2 [R120A](Homo sapiens (Human))
University Of Michigan Medical School

LigandPNGBDBM209868(3-[18-(2-carboxyethyl)-8,13-bis(ethenyl)-3,7,12,17...)
Affinity DataKd:  750nMpH: 8.0Assay Description:POX reactions were conducted in 2 ml of filtered and degassed 50 mM Tris-HCl, pH 8.0, containing 50 mM NaCl, 0.1 mM H2O2, 4.5 mM guaiacol, and the in...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetDimer of Prostaglandin G/H synthase 2 [S530A](Homo sapiens (Human))
University Of Michigan Medical School

LigandPNGBDBM209868(3-[18-(2-carboxyethyl)-8,13-bis(ethenyl)-3,7,12,17...)
Affinity DataKd:  190nMpH: 8.0Assay Description:POX reactions were conducted in 2 ml of filtered and degassed 50 mM Tris-HCl, pH 8.0, containing 50 mM NaCl, 0.1 mM H2O2, 4.5 mM guaiacol, and the in...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetProstaglandin G/H synthase 2 [S530A](Homo sapiens (Human))
University Of Michigan Medical School

LigandPNGBDBM209868(3-[18-(2-carboxyethyl)-8,13-bis(ethenyl)-3,7,12,17...)
Affinity DataKd:  240nMpH: 8.0Assay Description:POX reactions were conducted in 2 ml of filtered and degassed 50 mM Tris-HCl, pH 8.0, containing 50 mM NaCl, 0.1 mM H2O2, 4.5 mM guaiacol, and the in...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetProstaglandin G/H synthase 2 [Y385F](Homo sapiens (Human))
University Of Michigan Medical School

LigandPNGBDBM209868(3-[18-(2-carboxyethyl)-8,13-bis(ethenyl)-3,7,12,17...)
Affinity DataKd:  370nMpH: 8.0Assay Description:POX reactions were conducted in 2 ml of filtered and degassed 50 mM Tris-HCl, pH 8.0, containing 50 mM NaCl, 0.1 mM H2O2, 4.5 mM guaiacol, and the in...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed