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Target
NAD(P)H dehydrogenase [quinone] 1
Ligand
BDBM35530
Substrate
BDBM24778
Meas. Tech.
Inhibition of NQO1 (With 2 uM BSA)
pH
7.5000±n/a
Temperature
298.1500±n/a K
IC50
1600±424 nM
Citation
 Nolan, KA; Doncaster, JR; Dunstan, MS; Scott, KA; Frenkel, AD; Siegel, D; Ross, D; Barnes, J; Levy, C; Leys, D; Whitehead, RC; Stratford, IJ; Bryce, RA Synthesis and biological evaluation of coumarin-based inhibitors of NAD(P)H: quinone oxidoreductase-1 (NQO1). J Med Chem 52:7142-56 (2009) [PubMed]  Article 
Target
Name:
NAD(P)H dehydrogenase [quinone] 1
Synonyms:
Azoreductase | DT-diaphorase | Menadione reductase | NAD(P)H:quinone oxidoreductase 1 | Phylloquinone reductase | QR1 | Quinone Reductase 1 | Quinone reductase 1) | NQO1_HUMAN | NQO1 | DIA4 | NMOR1
Type:
Homodimer
Mol. Mass.:
30874.82
Organism:
Human
Description:
n/a
Residue:
274
Sequence:
MVGRRALIVLAHSERTSFNYAMKEAAAAALKKKGWEVVESDLYAMNFNPIISRKDITGKLKDPANFQYPAESVLAYKEGHLSPDIVAEQKKLEAADLVIFQFPLQWFGVPAILKGWFERVFIGEFAYTYAAMYDKGPFRSKKAVLSITTGGSGSMYSLQGIHGDMNVILWPIQSGILHFCGFQVLEPQLTYSIGHTPADARIQILEGWKKRLENIWDETPLYFAPSSLFDLNFQAGFLMKKEVQDEEKNKKFGLSVGHHLGKSIPTDNQIKARK
  
Inhibitor
Name:
BDBM35530
Synonyms:
symmetric dicoumarol analogue, 6
Type:
Small organic molecule
Emp. Form.:
TBD
Mol. Mass.:
TBD
SMILES:
TBD
Structure:
Search PDB for entries with ligand similarity:
Substrate
Name:
BDBM24778
Synonyms:
Vitamin K3 | cid_4055 | 2-methyl-1,4-dihydronaphthalene-1,4-dione | Menadione (Vitamin K3) | CHEMBL590 | Menadione | Menadione, 9 | 2-methyl-1,4-naphthoquinone, 5 | Menadione (5d)
Type:
Small organic molecule
Emp. Form.:
TBD
Mol. Mass.:
TBD
SMILES:
TBD
Structure:
Search PDB for entries with ligand similarity: