BDBM50544146 CHEMBL4648043
SMILES: CCC(C)[C@H](N)C(=O)NS(=O)(=O)OC[C@H]1OC[C@@H](OCCn2cc(nn2)-c2ccccc2)[C@H](O)[C@@H]1O
InChI Key: InChIKey=UZLLFMFZKAOOHK-AUNGJVSRSA-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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
tRNA synthetase (IleRS) (Escherichia coli) | BDBM50544146 (CHEMBL4648043) | KEGG UniProtKB/SwissProt GoogleScholar AffyNet | PC cid PC sid UniChem | PubMed | 114 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
KU Leuven Curated by ChEMBL | Assay Description Inhibition of Escherichia coli BL21(DE3) ileRS overexpressed in Escherichia coli Rosetta2(DE3) assessed as reduction in tRNA aminoacylation preincuba... | Bioorg Med Chem 28: (2020) | |||||||||||
More data for this Ligand-Target Pair |