BDBM50081838 CHEMBL318019::[(S)-2-Amino-3-(4-hydroxy-phenyl)-propionylamino]-(2,3,4-trihydroxy-phenyl)-acetic acid

SMILES: N[C@@H](Cc1ccc(O)cc1)C(=O)NC(C(O)=O)c1ccc(O)c(O)c1O

InChI Key: InChIKey=HMXPTPKHMLJMAZ-AMGKYWFPSA-N

Data: 1 IC50

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50081838   

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))	BDBM50081838 (CHEMBL318019 | [(S)-2-Amino-3-(4-hydroxy-phenyl)-p...) Show SMILES N[C@@H](Cc1ccc(O)cc1)C(=O)NC(C(O)=O)c1ccc(O)c(O)c1O Show InChI InChI=1S/C17H18N2O7/c18-11(7-8-1-3-9(20)4-2-8)16(24)19-13(17(25)26)10-5-6-12(21)15(23)14(10)22/h1-6,11,13,20-23H,7,18H2,(H,19,24)(H,25,26)/t11-,13?/m0/s1	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	510	n/a	n/a	n/a	n/a	n/a	n/a
SmithKline Beecham Pharmaceuticals Curated by ChEMBL					Assay Description Compound was tested for inhibition of Staphylococcus aureus tyrosyl tRNA Synthetase				Bioorg Med Chem Lett 9: 2859-62 (1999) BindingDB Entry DOI: 10.7270/Q2F18XX9
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