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Literature summary extracted from

  • Sakai, J.; Yoshimori, A.; Nose, Y.; Mizoroki, A.; Okita, N.; Takasawa, R.; Tanuma, S.
    Structure-based discovery of a novel non-peptidic small molecular inhibitor of caspase-3 (2008), Bioorg. Med. Chem., 16, 4854-4859.
    View publication on PubMed

Inhibitors

EC Number Inhibitors Comment Organism Structure
3.4.22.56 1,4-dihydroxy-2-naphthoic acid
-
 Homo sapiens
3.4.22.56 4-(ethoxycarbonylmethoxy)-1-hydroxy-2-naphthoic acid CS4566, a caspase-3-specific small molecular inhibitor, binding mode, overview Homo sapiens
3.4.22.56 Ac-DNLD-CHO from rational computational design, the inhibitor is specific due to the specific interaction of the NLD moiety with the active site of caspase-3, docking mode and site-directed mutagenesis analysis. In the active site of caspase-3, Asn in Ac-DNLDCHO specifically interacts with Ser209 in the S3 subsite, and Leu tightly interacts with the hydrophobic S2 subsite, overview Homo sapiens

Organism

EC Number Organism UniProt Comment Textmining
3.4.22.56 Homo sapiens
-
-
-

Source Tissue

EC Number Source Tissue Comment Organism Textmining
3.4.22.56 commercial preparation recombinant enzyme Homo sapiens
-

IC50 Value

EC Number IC50 Value IC50 Value Maximum Comment Organism Inhibitor Structure
3.4.22.56 0.0136
-
-
 Homo sapiens CS4566