BDBM79514 Erythrosin B::MLS001335987::SMR000875321::US11744839, Compound Erythrosin B::cid_25162930::sodium;2-(2,4,5,7-tetraiodo-3-keto-6-oxido-xanthen-9-yl)benzoate::sodium;2-(2,4,5,7-tetraiodo-3-oxido-6-oxo-9-xanthenyl)benzoate::sodium;2-(2,4,5,7-tetraiodo-3-oxido-6-oxoxanthen-9-yl)benzoate::sodium;2-[2,4,5,7-tetrakis(iodanyl)-3-oxidanidyl-6-oxidanylidene-xanthen-9-yl]benzoate

SMILES [O-]C(=O)c1ccccc1-c1c2cc(I)c([O-])c(I)c2oc2c(I)c(=O)c(I)cc12

InChI Key InChIKey=LAINPTZBIXYTIZ-UHFFFAOYSA-L

Data  5 IC50  1 Kd  1 EC50  1 ITC

  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 7 hits for monomerid = 79514   

TargetBeta-adrenergic receptor kinase 1(Homo sapiens (Human))
Nmmlsc

Curated by PubChem BioAssay
LigandPNGBDBM79514(Erythrosin B | MLS001335987 | SMR000875321 | US117...)
Affinity DataEC50:  1.47E+4nMAssay Description:University of New Mexico Assay Overview: Assay Support: 1 R03 DA030557-01A1 Project Title: RNA Aptamer-based screen for Selective Inhibitors of ...More data for this Ligand-Target Pair
In DepthDetails PCBioAssay
TargetHexokinase HKDC1 [W721R](Homo sapiens (Human))
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM79514(Erythrosin B | MLS001335987 | SMR000875321 | US117...)
Affinity DataIC50:  1.44E+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 DepthDetails PCBioAssay
TargetHexokinase HKDC1 [W721R](Homo sapiens (Human))
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM79514(Erythrosin B | MLS001335987 | SMR000875321 | US117...)
Affinity DataIC50:  4.72E+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 DepthDetails PCBioAssay
TargetFlavin reductase (NADPH)(Homo sapiens)
Korea Basic Science Institute

US Patent
LigandPNGBDBM79514(Erythrosin B | MLS001335987 | SMR000875321 | US117...)
Affinity DataKd:  160nMAssay Description:An enzyme activity assay for BLVRB was conducted. Since BLVRB catalyzes the NAD(P)H dependent readuction of FMN, changes in the NAD(P)H concentration...More data for this Ligand-Target Pair
In DepthDetails US Patent
TargetTyrosyl-DNA phosphodiesterase 2(Homo sapiens (Human))
The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay
LigandPNGBDBM79514(Erythrosin B | MLS001335987 | SMR000875321 | US117...)
Affinity DataIC50:  1.43E+4nMAssay Description:Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute (TS...More data for this Ligand-Target Pair
In DepthDetails PCBioAssay
TargetTyrosyl-DNA phosphodiesterase 2(Homo sapiens (Human))
The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay
LigandPNGBDBM79514(Erythrosin B | MLS001335987 | SMR000875321 | US117...)
Affinity DataIC50:  3.57E+4nMAssay Description:Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute (TS...More data for this Ligand-Target Pair
In DepthDetails PCBioAssay
TargetCarboxy-terminal domain RNA polymerase II polypeptide A small phosphatase 1(Homo sapiens (Human))
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM79514(Erythrosin B | MLS001335987 | SMR000875321 | US117...)
Affinity DataIC50:  1.89E+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 DepthDetails PCBioAssay

Activity Spreadsheet -- ITC Data from BindingDB

Found 1 hit for monomerid = 79514   

CellFlavin reductase (NADPH)(Homo sapiens)
Korea Basic Science Institute

US Patent
SyringePNGBDBM79514(Erythrosin B | MLS001335987 | SMR000875321 | US117...)
ITC DataΔG°: -9.29kcal/mole −TΔS°: -2.91kcal/mole ΔH°: -6.38kcal/mole logk: 6.54E+6
T: 25.00°C 
In DepthDetails US Patent