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BDBM50322608 CHEMBL1172388::alpha-Sulfanylpropylphosphonic acid

SMILES: CCC(=S)P(O)(O)O

InChI Key: InChIKey=SJAHWBMFNPYFHU-UHFFFAOYSA-N

Data: 3 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 3 hits for monomerid = 50322608   
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


(Aeromonas hydrophila)
BDBM50322608
PNG
(CHEMBL1172388 | alpha-Sulfanylpropylphosphonic aci...)
Show SMILES CCC(=S)P(O)(O)O
Show InChI InChI=1S/C3H9O3PS/c1-2-3(8)7(4,5)6/h4-7H,2H2,1H3
PDB
MMDB

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
1.50E+4n/an/an/an/an/an/an/an/a



University of Li£ge

Curated by ChEMBL


Assay Description
Inhibition of Aeromonas hydrophila cphA


J Med Chem 53: 4862-76 (2010)


Article DOI: 10.1021/jm100213c
BindingDB Entry DOI: 10.7270/Q2057G34
More data for this
Ligand-Target Pair
Beta-lactamase L1


(Stenotrophomonas maltophilia)
BDBM50322608
PNG
(CHEMBL1172388 | alpha-Sulfanylpropylphosphonic aci...)
Show SMILES CCC(=S)P(O)(O)O
Show InChI InChI=1S/C3H9O3PS/c1-2-3(8)7(4,5)6/h4-7H,2H2,1H3
PDB
MMDB

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
>4.00E+4n/an/an/an/an/an/an/an/a



University of Li£ge

Curated by ChEMBL


Assay Description
Inhibition of Stenotrophomonas maltophilia beta lactamase L1 in presence of Zn+ chelator


J Med Chem 53: 4862-76 (2010)


Article DOI: 10.1021/jm100213c
BindingDB Entry DOI: 10.7270/Q2057G34
More data for this
Ligand-Target Pair
Beta-lactamase L1


(Stenotrophomonas maltophilia)
BDBM50322608
PNG
(CHEMBL1172388 | alpha-Sulfanylpropylphosphonic aci...)
Show SMILES CCC(=S)P(O)(O)O
Show InChI InChI=1S/C3H9O3PS/c1-2-3(8)7(4,5)6/h4-7H,2H2,1H3
PDB
MMDB

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
>8.00E+4n/an/an/an/an/an/an/an/a



University of Li£ge

Curated by ChEMBL


Assay Description
Inhibition of Stenotrophomonas maltophilia beta lactamase L1 in absence of Zn+ chelator


J Med Chem 53: 4862-76 (2010)


Article DOI: 10.1021/jm100213c
BindingDB Entry DOI: 10.7270/Q2057G34
More data for this
Ligand-Target Pair