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Target
Retinal dehydrogenase 2
Ligand
BDBM50538688
Substrate
n/a
Meas. Tech.
ChEMBL_1973875 (CHEMBL4606693)
Ki
920±n/a nM
Citation
 Quattrini, L; Gelardi, ELM; Petrarolo, G; Colombo, G; Ferraris, DM; Picarazzi, F; Rizzi, M; Garavaglia, S; La Motta, C Progress in the Field of Aldehyde Dehydrogenase Inhibitors: Novel Imidazo[1,2- ACS Med Chem Lett 11:963-970 (2020) [PubMed]  Article 
Target
Name:
Retinal dehydrogenase 2
Synonyms:
AL1A2_HUMAN | ALDH1A2 | Aldehyde dehydrogenase family 1 member A2 | RALDH 2 | RALDH(II) | RALDH2 | Retinal dehydrogenase 2 | Retinaldehyde-specific dehydrogenase type 2
Type:
PROTEIN
Mol. Mass.:
56720.77
Organism:
Homo sapiens (Human)
Description:
ChEMBL_109700
Residue:
518
Sequence:
MTSSKIEMPGEVKADPAALMASLHLLPSPTPNLEIKYTKIFINNEWQNSESGRVFPVYNPATGEQVCEVQEADKADIDKAVQAARLAFSLGSVWRRMDASERGRLLDKLADLVERDRAVLATMESLNGGKPFLQAFYVDLQGVIKTFRYYAGWADKIHGMTIPVDGDYFTFTRHEPIGVCGQIIPWNFPLLMFAWKIAPALCCGNTVVIKPAEQTPLSALYMGALIKEAGFPPGVINILPGYGPTAGAAIASHIGIDKIAFTGSTEVGKLIQEAAGRSNLKRVTLELGGKSPNIIFADADLDYAVEQAHQGVFFNQGQCCTAGSRIFVEESIYEEFVRRSVERAKRRVVGSPFDPTTEQGPQIDKKQYNKILELIQSGVAEGAKLECGGKGLGRKGFFIEPTVFSNVTDDMRIAKEEIFGPVQEILRFKTMDEVIERANNSDFGLVAAVFTNDINKALTVSSAMQAGTVWINCYNALNAQSPFGGFKMSGNGREMGEFGLREYSEVKTVTVKIPQKNS
  
Inhibitor
Name:
BDBM50538688
Synonyms:
CHEMBL4642789
Type:
Small organic molecule
Emp. Form.:
C21H16N2O2
Mol. Mass.:
328.3639
SMILES:
COC(=O)c1ccc(cc1)-c1cccn2cc(nc12)-c1ccccc1
Structure:
Search PDB for entries with ligand similarity: