BDBM60927 1-anilinonaphthalene-8-sulfonic acid::8-Anilino-1-naphthalenesulfonic acid::ANS::Anilinonaphthalene-8-sulfonic acid (ANS)::BDBM50126831

SMILES OS(=O)(=O)c1cccc2cccc(Nc3ccccc3)c12

InChI Key InChIKey=FWEOQOXTVHGIFQ-UHFFFAOYSA-N

Data  3 KI  10 IC50  16 Kd  1 ITC

PDB links: 23 PDB IDs match this monomer.

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 16 hits for monomerid = 60927   

TargetFatty acid-binding protein 5 [K24A,R33A,K34A](Homo sapiens (Human))
Emory University

LigandPNGBDBM60927(1-anilinonaphthalene-8-sulfonic acid | 8-Anilino-1...)
Affinity DataKd:  1.26E+4nMpH: 8.2 T: 2°CAssay Description:In brief, both wild-type and mutant hFABP5 were expressed and purified to homogeneity as described above and dialyzed in PBS (pH 8.2). Binding affini...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetFatty acid-binding protein 5 [M35A,L60A](Homo sapiens (Human))
Emory University

LigandPNGBDBM60927(1-anilinonaphthalene-8-sulfonic acid | 8-Anilino-1...)
Affinity DataKd:  6.10E+3nMpH: 8.2 T: 2°CAssay Description:In brief, both wild-type and mutant hFABP5 were expressed and purified to homogeneity as described above and dialyzed in PBS (pH 8.2). Binding affini...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetFatty acid-binding protein, adipocyte(Homo sapiens (Human))
Bristol-Myers Squibb Pharmaceutical Research Institute

Curated by ChEMBL
LigandPNGBDBM60927(1-anilinonaphthalene-8-sulfonic acid | 8-Anilino-1...)
Affinity DataKd:  150nMAssay Description:Binding affinity to aFABPMore data for this Ligand-Target Pair
TargetTransthyretin(Homo sapiens (Human))
Universidade Federal Do Rio De Janeiro

Curated by ChEMBL
LigandPNGBDBM60927(1-anilinonaphthalene-8-sulfonic acid | 8-Anilino-1...)
Affinity DataKd:  1.10E+3nMAssay Description:Binding affinity to wild type human TTR denominated hormone binding site expressed in Escherichia coli assessed as dissociation constant for first li...More data for this Ligand-Target Pair
TargetTransthyretin(Homo sapiens (Human))
Universidade Federal Do Rio De Janeiro

Curated by ChEMBL
LigandPNGBDBM60927(1-anilinonaphthalene-8-sulfonic acid | 8-Anilino-1...)
Affinity DataKd:  4.80E+3nMAssay Description:Binding affinity to wild type human TTR denominated hormone binding site expressed in Escherichia coli assessed as dissociation constant for second l...More data for this Ligand-Target Pair
TargetTransthyretin(Homo sapiens (Human))
Universidade Federal Do Rio De Janeiro

Curated by ChEMBL
LigandPNGBDBM60927(1-anilinonaphthalene-8-sulfonic acid | 8-Anilino-1...)
Affinity DataKd:  1.80E+3nMAssay Description:Binding affinity to wild type human TTR denominated hormone binding site expressed in Escherichia coli by equilibrium dialysisMore data for this Ligand-Target Pair
TargetTransthyretin(Homo sapiens (Human))
Universidade Federal Do Rio De Janeiro

Curated by ChEMBL
LigandPNGBDBM60927(1-anilinonaphthalene-8-sulfonic acid | 8-Anilino-1...)
Affinity DataKd:  1.00E+4nMAssay Description:Binding affinity to wild type human TTR denominated hormone binding site expressed in Escherichia coli by direct fluorescence titration methodMore data for this Ligand-Target Pair
TargetTransthyretin(Homo sapiens (Human))
Universidade Federal Do Rio De Janeiro

Curated by ChEMBL
LigandPNGBDBM60927(1-anilinonaphthalene-8-sulfonic acid | 8-Anilino-1...)
Affinity DataKd:  1.10E+3nMAssay Description:Binding affinity to wild type human TTR denominated hormone binding site expressed in Escherichia coli assessed as dissociation constant for first li...More data for this Ligand-Target Pair
TargetTransthyretin(Homo sapiens (Human))
Universidade Federal Do Rio De Janeiro

Curated by ChEMBL
LigandPNGBDBM60927(1-anilinonaphthalene-8-sulfonic acid | 8-Anilino-1...)
Affinity DataKd:  4.80E+3nMAssay Description:Binding affinity to wild type human TTR denominated hormone binding site expressed in Escherichia coli assessed as dissociation constant for second l...More data for this Ligand-Target Pair
TargetTransthyretin(Homo sapiens (Human))
Universidade Federal Do Rio De Janeiro

Curated by ChEMBL
LigandPNGBDBM60927(1-anilinonaphthalene-8-sulfonic acid | 8-Anilino-1...)
Affinity DataKd:  4.30E+3nMAssay Description:Binding affinity to wild type human TTR denominated hormone binding site expressed in Escherichia coli by isothermal direct titrimetric assayMore data for this Ligand-Target Pair
TargetCyclin-dependent kinase 2(Homo sapiens (Human))
University Of Arizona

Curated by ChEMBL
LigandPNGBDBM60927(1-anilinonaphthalene-8-sulfonic acid | 8-Anilino-1...)
Affinity DataKd:  3.70E+4nMAssay Description:Binding affinity to human Cdk2 by fluorescence spectroscopyMore data for this Ligand-Target Pair
TargetCyclin-dependent kinase 2(Homo sapiens (Human))
University Of Arizona

Curated by ChEMBL
LigandPNGBDBM60927(1-anilinonaphthalene-8-sulfonic acid | 8-Anilino-1...)
Affinity DataKd:  3.70E+4nMAssay Description:Binding affinity to CDK2 (unknown origin)More data for this Ligand-Target Pair
TargetCyclin-dependent kinase 2(Homo sapiens (Human))
University Of Arizona

Curated by ChEMBL
LigandPNGBDBM60927(1-anilinonaphthalene-8-sulfonic acid | 8-Anilino-1...)
Affinity DataKd:  3.70E+4nMAssay Description:Binding affinity to human CDK2 (1 to 298 residues) expressed in Escherichia coli Tuner(DE3) assessed as dissociation constant by fluorescence spectro...More data for this Ligand-Target Pair
TargetFatty acid-binding protein 5(Homo sapiens (Human))
Emory University

LigandPNGBDBM60927(1-anilinonaphthalene-8-sulfonic acid | 8-Anilino-1...)
Affinity DataKd:  6.57E+3nMpH: 8.2 T: 2°CAssay Description:In brief, both wild-type and mutant hFABP5 were expressed and purified to homogeneity as described above and dialyzed in PBS (pH 8.2). Binding affini...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetFatty acid-binding protein 5(Mus musculus (Mouse))
Case Western Reserve University School of Medicine

LigandPNGBDBM60927(1-anilinonaphthalene-8-sulfonic acid | 8-Anilino-1...)
Affinity DataKd:  70nMAssay Description:The method entails two steps [Lin et al., Biochemistry, 38:185-190]. In the first step, the Kd for association of FABP5 with the fluorescent lipid pr...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetFatty acid-binding protein, intestinal(Homo sapiens (Human))
Monash University

LigandPNGBDBM60927(1-anilinonaphthalene-8-sulfonic acid | 8-Anilino-1...)
Affinity DataKd:  1.33E+4nMpH: 8.0 T: 2°CAssay Description:ITC experiments were carried out using an iTC200 microcalorimeter (MicroCal) with coin shaped sample cell (200 μL) at 37 C with stirring at 1000...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed

Activity Spreadsheet -- ITC Data from BindingDB

Found 1 hit for monomerid = 60927   

CellIntestinal fatty acid-binding protein (hIFABP)(Homo sapiens (Human))
Monash University

SyringePNGBDBM60927(1-anilinonaphthalene-8-sulfonic acid | 8-Anilino-1...)
ITC DataΔG°: -6.95kcal/mole −TΔS°: -3.27kcal/mole ΔH°: -3.65kcal/mole logk: 7.96E+4
pH: 8.0 T: 37.00°C 
In DepthDetails ArticlePubMed