| Reaction Details |
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 | Report a problem with these data |
| Target | Aldo-keto reductase family 1 member A1 |
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| Ligand | BDBM193852 |
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| Substrate/Competitor | n/a |
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| Meas. Tech. | ALR1 in vitro Inhibition Assay |
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| pH | 6.2±n/a |
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| IC50 | 1.71e+3± 1e+1 nM |
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| Comments | extracted |
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| Citation |  Ibrar, A; Tehseen, Y; Khan, I; Hameed, A; Saeed, A; Furtmann, N; Bajorath, J; Iqbal, J Coumarin-thiazole and -oxadiazole derivatives: Synthesis, bioactivity and docking studies for aldose/aldehyde reductase inhibitors. Bioorg Chem68:177-186 (2016) [PubMed] Article |
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| More Info.: | Get all data from this article, Assay Method |
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| Aldo-keto reductase family 1 member A1 |
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| Name: | Aldo-keto reductase family 1 member A1 |
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| Synonyms: | AK1A1_BOVIN | AKR1A1 | Aldehyde reductase (ALR1) |
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| Type: | Protein |
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| Mol. Mass.: | 36620.67 |
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| Organism: | Bos taurus (Cattle) |
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| Description: | n/a |
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| Residue: | 325 |
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| Sequence: | MAASCILLHTGQKMPLIGLGTWKSDPGQVKAAIKYALSVGYRHIDCAAIYGNETEIGEAL
KENVGPGKLVPREELFVTSKLWNTKHHPEDVEPALRKTLADLQLEYLDLYLMHWPYAFER
GDSPFPKNADGTIRYDSTHYKETWRALEALVAKGLVRALGLSNFNSRQIDDVLSVASVRP
AVLQVECHPYLAQNELIAHCQARNLEVTAYSPLGSSDRAWRDPEEPVLLKEPVVLALAEK
HGRSPAQILLRWQVQRKVSCIPKSVTPSRILENIQVFDFTFSPEEMKQLDALNKNLRFIV
PMLTVDGKRVPRDAGHPLYPFNDPY
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| BDBM193852 |
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| n/a |
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| Name | BDBM193852 |
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| Synonyms: | (E)-3-(2-(2-(1-(4-bromophenyl)ethylidene)hydrazinyl)thiazol-4-yl)-2H-chromen-2-one (6e) |
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| Type | Small organic molecule |
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| Emp. Form. | C20H14BrN3O2S |
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| Mol. Mass. | 440.313 |
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| SMILES | C\C(=N/Nc1nc(cs1)-c1cc2ccccc2oc1=O)c1ccc(Br)cc1 |
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| Structure | 
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