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TargetNAD(P)H dehydrogenase [quinone] 1
LigandBDBM50055708
Substrate/Competitorn/a
Meas. Tech.ChEMBL_452278 (CHEMBL901433)
IC50 650±n/a nM
Citation Nolan, KAZhao, HFaulder, PFFrenkel, ADTimson, DJSiegel, DRoss, DBurke, TRStratford, IJBryce, 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
More Info.:Get all data from this article,  Assay Method
 
NAD(P)H dehydrogenase [quinone] 1
Name:NAD(P)H dehydrogenase [quinone] 1
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)
Type:Homodimer
Mol. Mass.:30874.82
Organism:Homo sapiens (Human)
Description:n/a
Residue:274
Sequence:
MVGRRALIVLAHSERTSFNYAMKEAAAAALKKKGWEVVESDLYAMNFNPIISRKDITGKL
KDPANFQYPAESVLAYKEGHLSPDIVAEQKKLEAADLVIFQFPLQWFGVPAILKGWFERV
FIGEFAYTYAAMYDKGPFRSKKAVLSITTGGSGSMYSLQGIHGDMNVILWPIQSGILHFC
GFQVLEPQLTYSIGHTPADARIQILEGWKKRLENIWDETPLYFAPSSLFDLNFQAGFLMK
KEVQDEEKNKKFGLSVGHHLGKSIPTDNQIKARK
Blast this sequence in BindingDB or PDB
  Blast E-value cutoff:
BDBM50055708
n/a
NameBDBM50055708
Synonyms:4-hydroxy-3-[4-hydroxy-3-methoxyphenyl(4-hydroxy-2-oxo-2H-3-chromenyl)methyl]-2H-2-chromenone | CHEMBL392101 | CHEMBL83968
TypeSmall organic molecule
Emp. Form.C26H18O8
Mol. Mass.458.4163
SMILESCOc1cc(ccc1O)C(c1c(O)c2ccccc2oc1=O)c1c(O)c2ccccc2oc1=O
Structure
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