BDBM50161779 (S)-2-(5-Dimethylamino-naphthalene-1-sulfonylamino)-3-[4-(5-dimethylamino-naphthalene-1-sulfonyloxy)-phenyl]-propionic acid::CHEMBL176072::Dansyl derivative, DDT, 1L::Dansyl derivatives 18A, (R) isomer::Dansyltyrosine deriviative 21B::N,O-DIDANSYL-L-TYROSINE::N,O-diansyl-L-tyrosine

SMILES CN(C)c1cccc2c(cccc12)S(=O)(=O)N[C@@H](Cc1ccc(OS(=O)(=O)c2cccc3c(cccc23)N(C)C)cc1)C(O)=O

InChI Key InChIKey=LUBOPDUYHWABFG-NDEPHWFRSA-N

Data  5 KI  5 IC50

PDB links: 1 PDB ID matches this monomer.

  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 10 hits for monomerid = 50161779   

TargetThymidylate synthase(Lactobacillus casei)
Università

LigandPNGBDBM50161779((S)-2-(5-Dimethylamino-naphthalene-1-sulfonylamino...)
Affinity DataKi:  1.40E+3nMAssay Description:All compounds were screened for inhibitory activity against Lactobacillus casei thymidylate synthase (LcTS) and Escherichia coli thymidylate synthase...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetThymidylate synthase(Lactobacillus casei)
Università

LigandPNGBDBM50161779((S)-2-(5-Dimethylamino-naphthalene-1-sulfonylamino...)
Affinity DataKi:  1.40E+3nMAssay Description:Inhibitory constant against thymidylate synthase from Lactobacillus caseiMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetThymidylate synthase(Escherichia coli)
Università

Curated by ChEMBL
LigandPNGBDBM50161779((S)-2-(5-Dimethylamino-naphthalene-1-sulfonylamino...)
Affinity DataKi:  1.80E+3nMAssay Description:Inhibitory constant against thymidylate synthase from Escherichia coliMore data for this Ligand-Target Pair
TargetThymidylate synthase(Escherichia coli)
Università

LigandPNGBDBM50161779((S)-2-(5-Dimethylamino-naphthalene-1-sulfonylamino...)
Affinity DataKi:  1.80E+3nMAssay Description:All compounds were screened for inhibitory activity against Lactobacillus casei thymidylate synthase (LcTS) and Escherichia coli thymidylate synthase...More data for this Ligand-Target Pair
TargetThymidylate synthase(Homo sapiens (Human))
Università

Curated by ChEMBL
LigandPNGBDBM50161779((S)-2-(5-Dimethylamino-naphthalene-1-sulfonylamino...)
Affinity DataKi:  4.90E+4nMAssay Description:Inhibitory constant against human thymidylate synthaseMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetThymidylate synthase(Escherichia coli)
Università

LigandPNGBDBM50161779((S)-2-(5-Dimethylamino-naphthalene-1-sulfonylamino...)
Affinity DataIC50:  5.00E+3nMAssay Description:Affinity assay of specificities of thymidylate synthase (TS)inhibitorsMore data for this Ligand-Target Pair
TargetThymidylate synthase(Homo sapiens (Human))
Università

Curated by ChEMBL
LigandPNGBDBM50161779((S)-2-(5-Dimethylamino-naphthalene-1-sulfonylamino...)
Affinity DataIC50:  1.19E+5nMAssay Description:Affinity assay of specificities of thymidylate synthase (TS)inhibitorsMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetThymidylate synthase(Lactobacillus casei)
Università

LigandPNGBDBM50161779((S)-2-(5-Dimethylamino-naphthalene-1-sulfonylamino...)
Affinity DataIC50:  3.40E+3nMpH: 7.4 T: 2°CAssay Description:The enzyme assay were performed spectrophotometrically by following the absorbance at 340nm using a hewlett Packard 8453 UV spectrophotometer equippe...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetThymidylate synthase(Lactobacillus casei)
Università

LigandPNGBDBM50161779((S)-2-(5-Dimethylamino-naphthalene-1-sulfonylamino...)
Affinity DataIC50:  7.00E+4nMpH: 7.4 T: 2°CAssay Description:The enzyme assay were performed spectrophotometrically by following the absorbance at 340nm using a hewlett Packard 8453 UV spectrophotometer equippe...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetThymidylate synthase(Lactobacillus casei)
Università

LigandPNGBDBM50161779((S)-2-(5-Dimethylamino-naphthalene-1-sulfonylamino...)
Affinity DataIC50:  3.40E+3nMAssay Description:Affinity assay of specificities of thymidylate synthase (TS)inhibitorsMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed