Reaction Details |
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Target | Aldehyde dehydrogenase, dimeric NADP-preferring |
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Ligand | BDBM50585953 |
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Substrate/Competitor | n/a |
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Meas. Tech. | ChEMBL_2164375 (CHEMBL5049236) |
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IC50 | 13700±n/a nM |
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Citation | Ibrahim, AIM; Batlle, E; Sneha, S; Jiménez, R; Pequerul, R; Parés, X; Rüngeler, T; Jha, V; Tuccinardi, T; Sadiq, M; Frame, F; Maitland, NJ; Farrés, J; Pors, K Expansion of the 4-(Diethylamino)benzaldehyde Scaffold to Explore the Impact on Aldehyde Dehydrogenase Activity and Antiproliferative Activity in Prostate Cancer. J Med Chem65:3833-3848 (2022) [PubMed] Article |
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More Info.: | Get all data from this article, Assay Method |
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Aldehyde dehydrogenase, dimeric NADP-preferring |
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Name: | Aldehyde dehydrogenase, dimeric NADP-preferring |
Synonyms: | AL3A1_HUMAN | ALDH3 | ALDH3A1 | Aldehyde dehydrogenase 3A1 (ALDH3A1) | Aldehyde dehydrogenase family 3 member A1 (ALDH3A1) | Aldehyde dehydrogenase family 3 member A1 (ALDH3A1) (Q122A) |
Type: | Protein |
Mol. Mass.: | 50394.38 |
Organism: | Homo sapiens (Human) |
Description: | n/a |
Residue: | 453 |
Sequence: | MSKISEAVKRARAAFSSGRTRPLQFRIQQLEALQRLIQEQEQELVGALAADLHKNEWNAY
YEEVVYVLEEIEYMIQKLPEWAADEPVEKTPQTQQDELYIHSEPLGVVLVIGTWNYPFNL
TIQPMVGAIAAGNSVVLKPSELSENMASLLATIIPQYLDKDLYPVINGGVPETTELLKER
FDHILYTGSTGVGKIIMTAAAKHLTPVTLELGGKSPCYVDKNCDLDVACRRIAWGKFMNS
GQTCVAPDYILCDPSIQNQIVEKLKKSLKEFYGEDAKKSRDYGRIISARHFQRVMGLIEG
QKVAYGGTGDAATRYIAPTILTDVDPQSPVMQEEIFGPVLPIVCVRSLEEAIQFINQREK
PLALYMFSSNDKVIKKMIAETSSGGVAANDVIVHITLHSLPFGGVGNSGMGSYHGKKSFE
TFSHRRSCLVRPLMNDEGLKVRYPPSPAKMTQH
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BDBM50585953 |
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n/a |
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Name | BDBM50585953 |
Synonyms: | CHEMBL5087589 |
Type | Small organic molecule |
Emp. Form. | C13H18ClNO |
Mol. Mass. | 239.741 |
SMILES | CCCN(CCC)c1ccc(C=O)cc1Cl |
Structure |
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