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Target
Aldehyde dehydrogenase 1A1
Ligand
BDBM50003041
Substrate
n/a
Meas. Tech.
ChEBML_31159
IC50
25000±n/a nM
Citation
 Lee, MJ; Nagasawa, HT; Elberling, JA; DeMaster, EG Prodrugs of nitroxyl as inhibitors of aldehyde dehydrogenase. J Med Chem 35:3648-52 (1992) [PubMed]  Article 
Target
Name:
Aldehyde dehydrogenase 1A1
Synonyms:
AL1A1_RAT | Aldh | Aldh1a1
Type:
PROTEIN
Mol. Mass.:
54465.59
Organism:
Rattus norvegicus
Description:
ChEMBL_31158
Residue:
501
Sequence:
MSSPAQPAVPAPLANLKIQHTKIFINNEWHDSVSGKKFPVLNPATEEVICHVEEGDKADVDKAVKAARQAFQIGSPWRTMDASERGRLLNKLADLMERDRLLLATIEAINGGKVFANAYLSDLGGSIKALKYCAGWADKIHGQTIPSDGDIFTFTRREPIGVCGQIIPWNFPLLMFIWKIGPALSCGNTVVVKPAEQTPLTALHMASLIKEAGFPPGVVNIVPGYGPTAGAAISSHMDVDKVAFTGSTQVGKLIKEAAGKSNLKRVTLELGGKSPCIVFADADLDIAVEFAHHGVFYHQGQCCVAASRIFVEESVYDEFVRKSVERAKKYVLGNPLTQGINQGPQIDKEQHDKILDLIESGKKEGAKLECGGGRWGNKGFFVQPTVFSNVTDEMRIAKEEIFGPVQQIMKFKSIDDVIKRANNTTYGLAAGVFTKDLDRAITVSSALQAGVVWVNCYMILSAQCPFGGFKMSGNGRELGEHGLYEYTELKTVAMKISQKNS
  
Inhibitor
Name:
BDBM50003041
Synonyms:
CHEMBL121472 | N-(benzoyloxy)-N-cyanobenzamide
Type:
Small organic molecule
Emp. Form.:
C15H10N2O3
Mol. Mass.:
266.2515
SMILES:
O=C(ON(C#N)C(=O)c1ccccc1)c1ccccc1
Structure:
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