Ligand name: PINACOL[[2-AMINO-ALPHA-(1-CARBOXY-1-METHYLETHOXYIMINO)-4-THIAZOLEACETYL]AMINO]METHANEBORONATE
PDB ligand accession: CB4
DrugBank: DB04035
PubChem: 5849540
ChEMBL: CHEMBL1231661
InChI Key: ZECCQELUYUPTSB-UUASQNMZSA-N
SMILES: B(CNC(=O)C(=NOC(C)(C)C(=O)O)c1csc(n1)N)(O)O

ClassyFire chemical classification:

List of proteins that are targets for DB04035

# DrugDomain Data UniProt Accession Protein name Drug Action Affinity data
1 P62593_CB4 P62593 Beta-lactamase TEM (EC n/a
2 Q9L387_CB4 Q9L387 Beta-lactamase (EC 3.5.2.6) n/a
3 P00811_CB4 P00811 Beta-lactamase (EC 3.5.2.6) n/a
4 Q4H482_CB4 Q4H482 Beta-lactamase (EC 3.5.2.6) n/a
5 P0AD64_CB4 P0AD64 Beta-lactamase SHV-1 (EC n/a Ki(nM) = 2200.0
6 H6UQI0_CB4 H6UQI0 Beta-lactamase (EC 3.5.2.6) n/a
7 Q9L5C7_CB4 Q9L5C7 Beta-lactamase (EC 3.5.2.6) n/a
8 A0A2Z4SUB5_CB4 A0A2Z4SUB5 deleted n/a