BDBM50021961 CHEMBL286829::dipotassium 1-{[(3R,4S)-4-carboxylato-3-methyl-2,2-dioxido-6-oxo-2-thiabicyclo[3.2.0]hept-3-yl]methyl}-1H-1,2,3-triazole-4-carboxylate
SMILES: C[C@]1(Cn2cc(nn2)C([O-])=O)[C@@H](C2C(CC2=O)S1(=O)=O)C([O-])=O
InChI Key: InChIKey=GIFHLGGIPIAVNV-RMVUORRVSA-L
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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Beta-lactamase (TEM-1) (Escherichia coli) | BDBM50021961 (CHEMBL286829 | dipotassium 1-{[(3R,4S)-4-carboxyla...) | PDB UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | PubMed | n/a | n/a | 600 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA Curated by ChEMBL | Assay Description Inhibitory activity against Beta-lactamase from Bacillus sp. using penicillin G as substrate | J Med Chem 30: 1469-74 (1987) BindingDB Entry DOI: 10.7270/Q28G8JQ0 | |||||||||||
More data for this Ligand-Target Pair |