BDBM50518893 CHEMBL4545947

SMILES C[C@H](CS)C(=O)N[C@@H](B(O)O)c1ccc(F)cc1

InChI Key InChIKey=CDDJMEDWZMPIRW-GMSGAONNSA-N

Data  1 KI

PDB links: 1 PDB ID matches this monomer.

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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50518893   

TargetBeta-lactamase TEM(Escherichia coli)
Sichuan University

Curated by ChEMBL
LigandPNGBDBM50518893(CHEMBL4545947)
Show SMILES C[C@H](CS)C(=O)N[C@@H](B(O)O)c1ccc(F)cc1
Show InChI InChI=1S/C11H15BFNO3S/c1-7(6-18)11(15)14-10(12(16)17)8-2-4-9(13)5-3-8/h2-5,7,10,16-18H,6H2,1H3,(H,14,15)/t7-,10-/m1/s1
Affinity DataKi:  6.79E+4nMAssay Description:Inhibition of bacterial N-terminal His-tagged TEV protease site linked TEM-1 (24 to 286 amino acids) expressed in Escherichia coli Transetta (DE3) pr...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sidPDB