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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Beta-lactamase' and Ligand = 'BDBM50149790'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Beta-lactamase


(Escherichia coli)
BDBM50149790
PNG
(Aza-boronic acid derivative | CHEMBL184830)
Show SMILES Nc1cc(ccc1\N=N\c1cccc(c1)B(O)O)B(O)O
Show InChI InChI=1S/C12H13B2N3O4/c15-11-7-9(14(20)21)4-5-12(11)17-16-10-3-1-2-8(6-10)13(18)19/h1-7,18-21H,15H2/b17-16+
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
2.70E+3n/an/an/an/an/an/an/an/a



Università degli Studi di Modena e Reggio Emilia

Curated by ChEMBL


Assay Description
Apparent inhibition constant against Escherichia coli AmpC beta-lactamase


Bioorg Med Chem Lett 14: 3979-83 (2004)


Article DOI: 10.1016/j.bmcl.2004.05.054
BindingDB Entry DOI: 10.7270/Q2XW4J8P
More data for this
Ligand-Target Pair