| Reaction Details |
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 | Report a problem with these data |
| Target | NAD(P)H dehydrogenase [quinone] 1 |
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| Ligand | BDBM50055716 |
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| Substrate/Competitor | n/a |
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| Meas. Tech. | ChEMBL_452277 (CHEMBL901432) |
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| IC50 | 350±n/a nM |
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| Citation |  Nolan, KA; Zhao, H; Faulder, PF; Frenkel, AD; Timson, DJ; Siegel, D; Ross, D; Burke, TR; Stratford, IJ; Bryce, RA Coumarin-based inhibitors of human NAD(P)H:quinone oxidoreductase-1. Identification, structure-activity, off-target effects and in vitro human pancreatic cancer toxicity. J Med Chem50:6316-25 (2007) [PubMed] Article |
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| More Info.: | Get all data from this article, Assay Method |
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| NAD(P)H dehydrogenase [quinone] 1 |
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| Name: | NAD(P)H dehydrogenase [quinone] 1 |
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| Synonyms: | Azoreductase | DIA4 | DT-diaphorase | Menadione reductase | NAD(P)H:quinone oxidoreductase 1 | NMOR1 | NQO1 | NQO1_HUMAN | Phylloquinone reductase | QR1 | Quinone Reductase 1 | Quinone reductase 1) |
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| Type: | Homodimer |
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| Mol. Mass.: | 30874.82 |
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| Organism: | Homo sapiens (Human) |
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| Description: | n/a |
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| Residue: | 274 |
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| Sequence: | MVGRRALIVLAHSERTSFNYAMKEAAAAALKKKGWEVVESDLYAMNFNPIISRKDITGKL
KDPANFQYPAESVLAYKEGHLSPDIVAEQKKLEAADLVIFQFPLQWFGVPAILKGWFERV
FIGEFAYTYAAMYDKGPFRSKKAVLSITTGGSGSMYSLQGIHGDMNVILWPIQSGILHFC
GFQVLEPQLTYSIGHTPADARIQILEGWKKRLENIWDETPLYFAPSSLFDLNFQAGFLMK
KEVQDEEKNKKFGLSVGHHLGKSIPTDNQIKARK
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| BDBM50055716 |
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| n/a |
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| Name | BDBM50055716 |
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| Synonyms: | 4-hydroxy-3-(4-hydroxy-2-oxo-2H-3-chromenyl{4-[2-phenyl-(E)-1-ethenyl]phenyl}methyl)-2H-2-chromenone | CHEMBL238295 | CHEMBL284384 |
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| Type | Small organic molecule |
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| Emp. Form. | C33H22O6 |
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| Mol. Mass. | 514.5242 |
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| SMILES | Oc1c(C(c2ccc(\C=C\c3ccccc3)cc2)c2c(O)c3ccccc3oc2=O)c(=O)oc2ccccc12 |
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| Structure | 
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