BDBM50072692 CHEMBL2303732::N-[2-(6-Bromo-naphthalen-2-yloxy)-4-hydroxy-6-hydroxymethyl-5-(3,4,5-trihydroxy-6-hydroxymethyl-tetrahydro-pyran-2-yloxy)-tetrahydro-pyran-3-yl]-acetamide
SMILES: CC(=O)N[C@H]1[C@@H](O)[C@H](O[C@@H]2O[C@@H](CO)[C@H](O)[C@H](O)[C@@H]2O)[C@H](CO)O[C@H]1Oc1ccc2cc(Br)ccc2c1
InChI Key: InChIKey=BRFDZKHHLNQIBD-MBQUBCGXSA-N
Data: 1 KI
Target/Host (Institution) | Ligand | Target/Host Links | Ligand Links | Trg + Lig Links | Ki nM | ΔG° kcal/mole | IC50 nM | Kd nM | EC50/IC50 nM | koff s-1 | kon M-1s-1 | pH | Temp °C |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
N-acetyllactosaminide alpha-1,3-galactosyltransferase (Sus scrofa) | BDBM50072692 (CHEMBL2303732 | N-[2-(6-Bromo-naphthalen-2-yloxy)-...) | PDB MMDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | PubMed | 9.20E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Scripps Research Institute Curated by ChEMBL | Assay Description Compound was tested for the inhibition porcine alpha -1,3 -galactosyl transferase (alpha-1,3-GalT) | Bioorg Med Chem Lett 8: 3359-64 (1999) BindingDB Entry DOI: 10.7270/Q2GT5MB2 | |||||||||||
More data for this Ligand-Target Pair |