BDBM50248217 1-(4-Methoxyphenylsulfonamido)-3-morpholinopropan-2-yl dihydrogen phosphate::CHEMBL473552::HEA derivative, 7a
SMILES: COc1ccc(cc1)S(=O)(=O)NCC(CN1CCOCC1)OP(O)(O)=O
InChI Key: InChIKey=KQRLPNNZQJZXAV-UHFFFAOYSA-N
Data: 4 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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
MurC (Escherichia coli) | BDBM50248217 (1-(4-Methoxyphenylsulfonamido)-3-morpholinopropan-...) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | 4.90E+5 | n/a | n/a | n/a | n/a | 8.0 | 37 |
University of Ljubljana | Assay Description Compounds were tested for their inhibition of the addition of L-Ala, D-Glu, L-Lys or D-Ala-D-Ala to nucleotide precursors catalyzed by MurC from Esch... | Bioorg Chem 37: 217-22 (2009) Article DOI: 10.1016/j.bioorg.2009.09.001 BindingDB Entry DOI: 10.7270/Q2D21W5D | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Vancomycin/teicoplanin A-type resistance protein vanA (Enterococcus faecium) | BDBM50248217 (1-(4-Methoxyphenylsulfonamido)-3-morpholinopropan-...) | PDB MMDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | 2.24E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Ljubljana Curated by ChEMBL | Assay Description Inhibition of Enterococcus faecium VanA by pyruvate kinase/lactate dehydrogenase coupled assay | Bioorg Med Chem Lett 19: 1376-9 (2009) Article DOI: 10.1016/j.bmcl.2009.01.034 BindingDB Entry DOI: 10.7270/Q2HM58B5 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
MurF (Escherichia coli) | BDBM50248217 (1-(4-Methoxyphenylsulfonamido)-3-morpholinopropan-...) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | 5.30E+5 | n/a | n/a | n/a | n/a | 8.0 | 37 |
University of Ljubljana | Assay Description Compounds were tested for their inhibition of the addition of L-Ala, D-Glu, L-Lys or D-Ala-D-Ala to nucleotide precursors catalyzed by MurC from Esch... | Bioorg Chem 37: 217-22 (2009) Article DOI: 10.1016/j.bioorg.2009.09.001 BindingDB Entry DOI: 10.7270/Q2D21W5D | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
MurE (Staphylococcus aureus) | BDBM50248217 (1-(4-Methoxyphenylsulfonamido)-3-morpholinopropan-...) | PDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | 6.00E+3 | n/a | n/a | n/a | n/a | 8.0 | 37 |
University of Ljubljana | Assay Description Compounds were tested for their inhibition of the addition of L-Ala, D-Glu, L-Lys or D-Ala-D-Ala to nucleotide precursors catalyzed by MurC from Esch... | Bioorg Chem 37: 217-22 (2009) Article DOI: 10.1016/j.bioorg.2009.09.001 BindingDB Entry DOI: 10.7270/Q2D21W5D | |||||||||||
More data for this Ligand-Target Pair |