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BDBM50281090 (3S,4R)-1-Acetyl-3-methoxy-4-phenyl-azetidin-2-one::CHEMBL84758

SMILES: CO[C@H]1[C@H](N(C(C)=O)C1=O)c1ccccc1

InChI Key: InChIKey=QNWKONRKOPHGOY-MNOVXSKESA-N

Data: 3 IC50

Find this compound or compounds like it in BindingDB or PDB:
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50281090   
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
Leukocyte elastase


(Homo sapiens (Human))
BDBM50281090
PNG
((3S,4R)-1-Acetyl-3-methoxy-4-phenyl-azetidin-2-one...)
Show SMILES CO[C@H]1[C@H](N(C(C)=O)C1=O)c1ccccc1
Show InChI InChI=1S/C12H13NO3/c1-8(14)13-10(11(16-2)12(13)15)9-6-4-3-5-7-9/h3-7,10-11H,1-2H3/t10-,11+/m1/s1
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
n/an/a 1.60E+3n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
The compound was evaluated in vitro for the inhibition of human leukocyte elastase(HLE)


Bioorg Med Chem Lett 3: 2547-2552 (1993)


Article DOI: 10.1016/S0960-894X(01)80714-9
BindingDB Entry DOI: 10.7270/Q2CV4HNW
More data for this
Ligand-Target Pair
Pancreatic elastase


(Sus scrofa)
BDBM50281090
PNG
((3S,4R)-1-Acetyl-3-methoxy-4-phenyl-azetidin-2-one...)
Show SMILES CO[C@H]1[C@H](N(C(C)=O)C1=O)c1ccccc1
Show InChI InChI=1S/C12H13NO3/c1-8(14)13-10(11(16-2)12(13)15)9-6-4-3-5-7-9/h3-7,10-11H,1-2H3/t10-,11+/m1/s1
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
n/an/a 700n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
The compound was evaluated in vitro for the inhibition of pancreatitic porcine elastase(PPE)


Bioorg Med Chem Lett 3: 2547-2552 (1993)


Article DOI: 10.1016/S0960-894X(01)80714-9
BindingDB Entry DOI: 10.7270/Q2CV4HNW
More data for this
Ligand-Target Pair
Elastase 2A


(Rattus norvegicus)
BDBM50281090
PNG
((3S,4R)-1-Acetyl-3-methoxy-4-phenyl-azetidin-2-one...)
Show SMILES CO[C@H]1[C@H](N(C(C)=O)C1=O)c1ccccc1
Show InChI InChI=1S/C12H13NO3/c1-8(14)13-10(11(16-2)12(13)15)9-6-4-3-5-7-9/h3-7,10-11H,1-2H3/t10-,11+/m1/s1
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
n/an/a 400n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
The compound was evaluated in vitro for the inhibition of rat leukocyte elastase(RLE)


Bioorg Med Chem Lett 3: 2547-2552 (1993)


Article DOI: 10.1016/S0960-894X(01)80714-9
BindingDB Entry DOI: 10.7270/Q2CV4HNW
More data for this
Ligand-Target Pair