Target
Mitochondrial peptide methionine sulfoxide reductase
Ligand
BDBM95342
Substrate
n/a
IC50
138599±n/a nM
Citation
 PubChem, PC Absorbance-based biochemical high throughput dose response assay to identify inhibitors of Methionine sulfoxide reductase A (MsrA) PubChem Bioassay (2013)[AID] 
Target
Name:
Mitochondrial peptide methionine sulfoxide reductase
Synonyms:
MSRA | MSRA protein | MSRA_BOVIN
Type:
Enzyme Catalytic Domain
Mol. Mass.:
25822.90
Organism:
Bos taurus
Description:
gi_73586699
Residue:
233
Sequence:
MLSATRRALQLFHSLFPIPRMGDSAAKIVSPQEALPGRKEPLVVAAKHHVNGNRTVEPFPEGTQMAVFGMGCFWGAERKFWTLKGVYSTQVGFAGGYTPNPTYKEVCSGKTGHAEVVRVVFQPEHISFEELLKVFWENHDPTQGMRQGNDHGSQYRSAIYPTSAEHVGAALKSKEDYQKVLSEHGFGLITTDIREGQTFYYAEDYHQQYLSKDPDGYCGLGGTGVSCPLGIKK
  
Inhibitor
Name:
BDBM95342
Synonyms:
(E,4Z)-4-[amino-[4-(4-methoxyphenyl)-1-piperazinyl]methylidene]-2-cyano-2-pentenedioic acid diethyl ester | (E,4Z)-4-[amino-[4-(4-methoxyphenyl)piperazino]methylene]-2-cyano-pent-2-enedioic acid diethyl ester | MLS000539532 | SMR000125190 | cid_9551595 | diethyl (E,4Z)-4-[amino-[4-(4-methoxyphenyl)piperazin-1-yl]methylidene]-2-cyanopent-2-enedioate | diethyl (E,4Z)-4-[azanyl-[4-(4-methoxyphenyl)piperazin-1-yl]methylidene]-2-cyano-pent-2-enedioate | diethyl 4-{amino[4-(4-methoxyphenyl)piperazino]methylene}-2-cyano-2-pentenedioate
Type:
Small organic molecule
Emp. Form.:
C22H28N4O5
Mol. Mass.:
428.4815
SMILES:
CCOC(=O)C(C=C(C(=O)OCC)C(=N)N1CCN(CC1)c1ccc(OC)cc1)C#N |w:6.5|
Structure:
Search PDB for entries with ligand similarity: