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BDBM36440 CID25181259::ZINC13785333, 4

SMILES: C[C@H](N1C(=O)C2C3CCC(C3)C2C1=O)C([O-])=O

InChI Key: InChIKey=REFMTLIXGKZVDF-OQOOARCMSA-M

Data: 2 KI

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 = 36440   
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 CTX-M-1


(Escherichia coli)
BDBM36440
PNG
(CID25181259 | ZINC13785333, 4)
Show SMILES C[C@H](N1C(=O)C2C3CCC(C3)C2C1=O)C([O-])=O
Show InChI InChI=1S/C12H15NO4/c1-5(12(16)17)13-10(14)8-6-2-3-7(4-6)9(8)11(13)15/h5-9H,2-4H2,1H3,(H,16,17)/p-1/t5-,6?,7?,8?,9?/m0/s1
PDB

KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem
Article
PubMed
1.30E+6n/an/an/an/an/an/a7.0n/a



University of California, San Francisco



Assay Description
Class A Beta-lactamase CTX-M inhibition assay


Nat Chem Biol 5: 358-64 (2009)


Article DOI: 10.1038/nchembio.155
BindingDB Entry DOI: 10.7270/Q24M92WZ
More data for this
Ligand-Target Pair
Beta-lactamase


(Escherichia coli)
BDBM36440
PNG
(CID25181259 | ZINC13785333, 4)
Show SMILES C[C@H](N1C(=O)C2C3CCC(C3)C2C1=O)C([O-])=O
Show InChI InChI=1S/C12H15NO4/c1-5(12(16)17)13-10(14)8-6-2-3-7(4-6)9(8)11(13)15/h5-9H,2-4H2,1H3,(H,16,17)/p-1/t5-,6?,7?,8?,9?/m0/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem
Article
PubMed
2.20E+6n/an/an/an/an/an/a7.0n/a



University of California, San Francisco



Assay Description
Class C Beta-lactamase AmpC inhibition assay


Nat Chem Biol 5: 358-64 (2009)


Article DOI: 10.1038/nchembio.155
BindingDB Entry DOI: 10.7270/Q24M92WZ
More data for this
Ligand-Target Pair