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BDBM50327179 (S)-3-(2-(2-aminothiazol-4-yl)-2-((1,5-dihydroxy-4-oxo-1,4-dihydropyridin-2-yl)methoxyimino)acetamido)-2,2-dimethyl-4-oxoazetidin-1-yl hydrogen sulfate::CHEMBL1256967

SMILES: CC1(C)[C@H](NC(=O)C(=N/OCc2cc(=O)c(O)cn2O)\c2csc(N)n2)C(=O)N1OS(O)(=O)=O

InChI Key: InChIKey=KLFSEZJCLYBFKQ-OUNVWFRENA-N

Data: 2 IC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50327179   
Target/Host
(Institution)
LigandTarget/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
pHTemp
°C
Beta-lactamase


(Citrobacter freundii)
BDBM50327179
PNG
((S)-3-(2-(2-aminothiazol-4-yl)-2-((1,5-dihydroxy-4...)
Show SMILES CC1(C)[C@H](NC(=O)C(=N/OCc2cc(=O)c(O)cn2O)\c2csc(N)n2)C(=O)N1OS(O)(=O)=O
Show InChI InChI=1/C16H18N6O10S2/c1-16(2)12(14(26)22(16)32-34(28,29)30)19-13(25)11(8-6-33-15(17)18-8)20-31-5-7-3-9(23)10(24)4-21(7)27/h3-4,6,12,24,27H,5H2,1-2H3,(H2,17,18)(H,19,25)(H,28,29,30)/b20-11-/t12-/s2
PDB
MMDB

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
CHEMBL
KEGG
PC cid
PC sid
UniChem

Patents

Article
PubMed
n/an/a 2.70E+3n/an/an/an/an/an/a



Basilea Pharmaceutica International Ltd.

Curated by ChEMBL


Assay Description
Inhibition of Citrobacter freundii AmpC


Antimicrob Agents Chemother 54: 2291-302 (2010)


Article DOI: 10.1128/AAC.01525-09
BindingDB Entry DOI: 10.7270/Q20P1071
More data for this
Ligand-Target Pair
AmpC


(Escherichia coli)
BDBM50327179
PNG
((S)-3-(2-(2-aminothiazol-4-yl)-2-((1,5-dihydroxy-4...)
Show SMILES CC1(C)[C@H](NC(=O)C(=N/OCc2cc(=O)c(O)cn2O)\c2csc(N)n2)C(=O)N1OS(O)(=O)=O
Show InChI InChI=1/C16H18N6O10S2/c1-16(2)12(14(26)22(16)32-34(28,29)30)19-13(25)11(8-6-33-15(17)18-8)20-31-5-7-3-9(23)10(24)4-21(7)27/h3-4,6,12,24,27H,5H2,1-2H3,(H2,17,18)(H,19,25)(H,28,29,30)/b20-11-/t12-/s2
GoogleScholar
CHEMBL
KEGG
PC cid
PC sid
UniChem

Patents

Article
PubMed
n/an/a 500n/an/an/an/an/an/a



Basilea Pharmaceutica International Ltd.

Curated by ChEMBL


Assay Description
Inhibition of Escherichia coli ATCC 25922 AmpC


Antimicrob Agents Chemother 54: 2291-302 (2010)


Article DOI: 10.1128/AAC.01525-09
BindingDB Entry DOI: 10.7270/Q20P1071
More data for this
Ligand-Target Pair