BDBM50097745 CHEMBL159436::[2-Amino-3-((S)-4-hydroxy-phenyl)-propionylamino]-((2S,3R,4S,5S)-3,4,5-trihydroxy-tetrahydro-pyran-2-yl)-acetic acid
SMILES: N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@H]([C@@H]1OC[C@H](O)[C@H](O)[C@H]1O)C(O)=O
InChI Key: InChIKey=BMLUBZPHAMWTMM-VPCRRHSYSA-N
Data: 1 IC50
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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Tyrosyl-tRNA synthetase (Homo sapiens (Human)) | BDBM50097745 (CHEMBL159436 | [2-Amino-3-((S)-4-hydroxy-phenyl)-p...) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL KEGG PC cid PC sid UniChem Similars | PubMed | n/a | n/a | 260 | n/a | n/a | n/a | n/a | n/a | n/a |
GlaxoSmithKline Curated by ChEMBL | Assay Description Inhibitory activity against Staphylococcus aureus tyrosyl tRNA synthetase (YRS) using aminoacylation assay | Bioorg Med Chem Lett 11: 711-4 (2001) BindingDB Entry DOI: 10.7270/Q2445KR1 | |||||||||||
More data for this Ligand-Target Pair |