Reaction Details
Report a problem with these data
Report a problem with these dataTarget
Polyphenol oxidase 1 [N65D,S176D,K211T,P277A,P406L]
Ligand
BDBM173587
Substrate
n/a
Meas. Tech.
Enzymatic Activity Assay
pH
6.8±n/a
Ki
3.8e+3±n/a nM
IC50
1.04e+4± 6.5e+2 nM
Comments
extracted
Citation
Radhakrishnan, S; Shimmon, R; Conn, C; Baker, A Development of hydroxylated naphthylchalcones as polyphenol oxidase inhibitors: Synthesis, biochemistry and molecular docking studies. Bioorg Chem 63:116-22 (2015) [PubMed] Article More Info.:
Target
Name:
Polyphenol oxidase 1 [N65D,S176D,K211T,P277A,P406L]
Synonyms:
PPO1 | PPO1_AGABI | Polyphenol oxidase (PPO)
Type:
Protein
Mol. Mass.:
63874.81
Organism:
Agaricus bisporus (Mushroom)
Description:
K9HG96
Residue:
568
Sequence:
MSHLLVSPLGGGVQPRLEINNFVKNDRQFSLYVQALDRMYATPQNETASYFQVAGVHGYPLIPFNDAVGPTEFSPFDQWTGYCTHGSTLFPTWHRPYVLILEQILSGHAQQIADTYTVNKSEWKKAATEFRHPYWDWASNSVPPPEVISLPKVTITTPNGQKTSVANPLMRYTFNPVNDGGFYGPYNQWDTTLRQPDSTGVNAKDNVNRLTSVLKNAQASLTRATYDMFNRVTTWPHFSSHTPASGGSTSNSIEAIHDNIHVLVGGNGHMSDPSVAAFDPIFFLHHANVDRLIALWSAIRYDVWTSPGDAQFGTYTLRYKQSVDESTDLAPWWKTQNEYWKSNELRSTESLGYTYPEFVGLDMYNKDAVNKTISRKVAQLYGPQRGGQRSLVEDLSNSHARRSQRLAKRSRLGQLLKGLFSDWSAQIKFNRHEVGQSFSVCLFLGNVPEDPREWLVSPNLVGARHAFVRSVKTDHVAEEIGFIPINQWIAEHTGLPSFAVDLVKPLLAQGLQWRVLLADGTPAELDSLEVTILEVPSELTDDEPNPRSRPPRYHKDITHGKRGGCREA
Inhibitor
Name:
BDBM173587
Synonyms:
(2E)-3-(3,5-dihydroxyphenyl)-1-(3-hydroxynaphthalen-2-yl)prop-2-en-1-one (5b)
Type:
Small organic molecule
Emp. Form.:
C19H14O4
Mol. Mass.:
306.3121
SMILES:
Oc1cc(O)cc(\C=C\C(=O)c2cc3ccccc3cc2O)c1
Structure:
