BDBM21532 N-[(2R,3R,4R,5S,6R)-5-{[(2S,3R,4S,5R,6R)-4-({[(2S,3R,4S,5R,6R)-2-{[(2R,3S,4R,5R,6R)-5-acetamido-4-hydroxy-2-(hydroxymethyl)-6-methoxyoxan-3-yl]oxy}-3,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl]carbamothioyl}amino)-3,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-4-hydroxy-6-(hydroxymethyl)-2-methoxyoxan-3-yl]acetamide::Thioureido N-acetyllactosamine derivative, 16

SMILES CO[C@@H]1O[C@H](CO)[C@@H](O[C@@H]2O[C@H](CO)[C@H](O)[C@H](NC(=S)N[C@H]3[C@@H](O)[C@@H](CO)O[C@@H](O[C@H]4[C@H](O)[C@@H](NC(C)=O)[C@H](OC)O[C@@H]4CO)[C@@H]3O)[C@H]2O)[C@H](O)[C@H]1NC(C)=O

InChI Key InChIKey=XFKWSDCKYYNBQT-MZBPWKRKSA-N

Data  5 Kd

  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 = 21532   

TargetGalectin-1(Homo sapiens (Human))
Lund University

LigandPNGBDBM21532(N-[(2R,3R,4R,5S,6R)-5-{[(2S,3R,4S,5R,6R)-4-({[(2S,...)
Affinity DataKd:  5.80E+4nMpH: 7.2 T: 2°CAssay Description:In fluorescence polarization measurements, a fluorescent probe was excited with plane-polarized light and the degree of polarization remaining in the...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetGalectin-3(Homo sapiens (Human))
Lund University

LigandPNGBDBM21532(N-[(2R,3R,4R,5S,6R)-5-{[(2S,3R,4S,5R,6R)-4-({[(2S,...)
Affinity DataKd:  1.60E+5nMpH: 7.2 T: 2°CAssay Description:In fluorescence polarization measurements, a fluorescent probe was excited with plane-polarized light and the degree of polarization remaining in the...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetGalectin-9(Homo sapiens (Human))
Lund University

LigandPNGBDBM21532(N-[(2R,3R,4R,5S,6R)-5-{[(2S,3R,4S,5R,6R)-4-({[(2S,...)
Affinity DataKd:  2.40E+5nMAssay Description:In fluorescence polarization measurements, a fluorescent probe was excited with plane-polarized light and the degree of polarization remaining in the...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetGalectin-8(Homo sapiens (Human))
Lund University

LigandPNGBDBM21532(N-[(2R,3R,4R,5S,6R)-5-{[(2S,3R,4S,5R,6R)-4-({[(2S,...)
Affinity DataKd: >3.00E+6nMAssay Description:In fluorescence polarization measurements, a fluorescent probe was excited with plane-polarized light and the degree of polarization remaining in the...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetGalectin-7(Homo sapiens (Human))
Lund University

LigandPNGBDBM21532(N-[(2R,3R,4R,5S,6R)-5-{[(2S,3R,4S,5R,6R)-4-({[(2S,...)
Affinity DataKd:  1.70E+5nMAssay Description:In fluorescence polarization measurements, a fluorescent probe was excited with plane-polarized light and the degree of polarization remaining in the...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed