BDBM50339865 6-(4-(aminomethyl)phenoxy)benzo[c][1,2]oxaborol-1(3H)-ol::CHEMBL1761271
SMILES: NCc1ccc(Oc2ccc3COB(O)c3c2)cc1
InChI Key: InChIKey=XLFGSVPPEZNIPQ-UHFFFAOYSA-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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Beta-lactamase (Enterobacter cloacae) | BDBM50339865 (6-(4-(aminomethyl)phenoxy)benzo[c][1,2]oxaborol-1(...) | PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Patents Similars | Article PubMed | 1.33E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Anacor Pharmaceuticals, Inc. Curated by ChEMBL | Assay Description Inhibition of Enterobacter cloacae P99 beta-lactamase AmpC P99 using nitrocefin as substrate after 30 mins by spectrophotometric analysis | Bioorg Med Chem Lett 21: 2533-6 (2011) Article DOI: 10.1016/j.bmcl.2011.02.024 BindingDB Entry DOI: 10.7270/Q2G44QK5 | |||||||||||
More data for this Ligand-Target Pair |