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Target
Beta-lactamase
Ligand
BDBM83216
Substrate
n/a
Meas. Tech.
Counterscreen for inhibitors of TLR9-MyD88 binding: fluorescence-based cell-based high throughput dose response assay to identify non-selective inhibitors of the beta-lactamase enzyme (BLA)
IC50
4736±n/a nM
Citation
 PubChem, PC Counterscreen for inhibitors of TLR9-MyD88 binding: fluorescence-based cell-based high throughput dose response assay to identify non-selective inhibitors of the beta-lactamase enzyme (BLA) PubChem Bioassay (2011)[AID] 
Target
Name:
Beta-lactamase
Synonyms:
Beta lactamase
Type:
Enzyme Catalytic Domain
Mol. Mass.:
31513.38
Organism:
Pseudomonas aeruginosa
Description:
gi_114881106
Residue:
286
Sequence:
MSIQHFRVALIPFFAAFCLPVFAHPETLVKVKDAEDKLGARVGYIELDLNSGKILESFRPEERFPMMSTFKVLLCGAVLSRVDAGQEQLGRRIHYSQNDLVEYSPVTEKHLTDGMTVRELCSAAITMSDNTAANLLLTTIGGPKELTAFLHNMGDHVTRLDRWEPELNEAIPNDERDTTMPAAMATTLRKLLTGELLTLASRQQLIDWMEADKVAGPLLRSALPAGWFIADKSGAGERGSRGIIAALGPDGKPSRIVVIYTTGSQATMDERNRQIAEIGASLIKHW
  
Inhibitor
Name:
BDBM83216
Synonyms:
3-amino-4-(4-chlorophenyl)-6-(2-thienyl)thieno[2,3-b]pyridine-2-carbonitrile | 3-amino-4-(4-chlorophenyl)-6-thiophen-2-yl-2-thieno[2,3-b]pyridinecarbonitrile | 3-amino-4-(4-chlorophenyl)-6-thiophen-2-ylthieno[2,3-b]pyridine-2-carbonitrile | 3-azanyl-4-(4-chlorophenyl)-6-thiophen-2-yl-thieno[2,3-b]pyridine-2-carbonitrile | MLS000324481 | SMR000160398 | cid_1005239
Type:
Small organic molecule
Emp. Form.:
C18H10ClN3S2
Mol. Mass.:
367.875
SMILES:
Nc1c(sc2nc(cc(-c3ccc(Cl)cc3)c12)-c1cccs1)C#N
Structure:
Search PDB for entries with ligand similarity: