Found 3 hits in this display Target/Host
(Institution) | Ligand | Target/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 | pH | Temp
°C |
|---|
Beta-lactamase
(Enterobacter cloacae) | BDBM50088807
(CHEMBL435467 | Sodium; (R)-3,4-dimethyl-5,5,8-trio...)Show SMILES CC1C(C)=C(N2[C@@H](\C(=C/c3ccccn3)C2=O)S1(=O)=O)C([O-])=O |c:3| Show InChI InChI=1S/C15H14N2O5S/c1-8-9(2)23(21,22)14-11(7-10-5-3-4-6-16-10)13(18)17(14)12(8)15(19)20/h3-7,9,14H,1-2H3,(H,19,20)/p-1/b11-7-/t9?,14-/m1/s1 | PDB
MMDB
UniProtKB/TrEMBL
B.MOAD
DrugBank
GoogleScholar
AffyNet 
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 3.90E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Southern Methodist University
Curated by ChEMBL
| Assay Description
Inhibition of Class C beta-lactamase from E. cloacae strain P99 |
Bioorg Med Chem Lett 10: 847-51 (2000)
BindingDB Entry DOI: 10.7270/Q2NG4PVB |
More data for this
Ligand-Target Pair | |
Beta-lactamase
(Staphylococcus aureus) | BDBM50088807
(CHEMBL435467 | Sodium; (R)-3,4-dimethyl-5,5,8-trio...)Show SMILES CC1C(C)=C(N2[C@@H](\C(=C/c3ccccn3)C2=O)S1(=O)=O)C([O-])=O |c:3| Show InChI InChI=1S/C15H14N2O5S/c1-8-9(2)23(21,22)14-11(7-10-5-3-4-6-16-10)13(18)17(14)12(8)15(19)20/h3-7,9,14H,1-2H3,(H,19,20)/p-1/b11-7-/t9?,14-/m1/s1 | PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 7.41E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Southern Methodist University
Curated by ChEMBL
| Assay Description
The compound was evaluated for inhibition against Beta-lactamase TEM derived from Staphylococcus aureus |
Bioorg Med Chem Lett 10: 847-51 (2000)
BindingDB Entry DOI: 10.7270/Q2NG4PVB |
More data for this
Ligand-Target Pair | |
Beta-lactamase
(Staphylococcus aureus) | BDBM50088807
(CHEMBL435467 | Sodium; (R)-3,4-dimethyl-5,5,8-trio...)Show SMILES CC1C(C)=C(N2[C@@H](\C(=C/c3ccccn3)C2=O)S1(=O)=O)C([O-])=O |c:3| Show InChI InChI=1S/C15H14N2O5S/c1-8-9(2)23(21,22)14-11(7-10-5-3-4-6-16-10)13(18)17(14)12(8)15(19)20/h3-7,9,14H,1-2H3,(H,19,20)/p-1/b11-7-/t9?,14-/m1/s1 | PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 1.02E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
Southern Methodist University
Curated by ChEMBL
| Assay Description
The compound was evaluated for inhibition against Beta-lactamase derived from Staphylococcus aureus |
Bioorg Med Chem Lett 10: 847-51 (2000)
BindingDB Entry DOI: 10.7270/Q2NG4PVB |
More data for this
Ligand-Target Pair | |