For research use only. Not for therapeutic Use.
M77976(CAT: I007694) is a selective, ATP-competitive inhibitor of pyruvate dehydrogenase kinase isoform 4 (PDK4), with an IC₅₀ of 648 μM. By binding to the ATP-binding pocket, M77976 induces local conformational changes and complete disordering of the ATP lid, disrupting kinase activity. Structural studies reveal that M77976 forms hydrophobic interactions with key residues including Asn258, Ala262, Val298, Leu306, and Thr358 of PDK4. This compound is a valuable tool for probing PDK4 function in metabolic regulation and energy homeostasis. M77976 is particularly relevant in obesity and diabetes research, where PDK4 plays a critical role in glucose and lipid metabolism.
| CAS Number | 394237-61-7 |
| Synonyms | 4-[4-(4-methoxyphenyl)-5-methyl-1H-pyrazol-3-yl]benzene-1,3-diol |
| Molecular Formula | C17H16N2O3 |
| Purity | ≥95% |
| IUPAC Name | 4-[4-(4-methoxyphenyl)-5-methyl-1H-pyrazol-3-yl]benzene-1,3-diol |
| InChI | InChI=1S/C17H16N2O3/c1-10-16(11-3-6-13(22-2)7-4-11)17(19-18-10)14-8-5-12(20)9-15(14)21/h3-9,20-21H,1-2H3,(H,18,19) |
| InChIKey | GSBFARPNIZUMHA-UHFFFAOYSA-N |
| SMILES | CC1=C(C(=NN1)C2=C(C=C(C=C2)O)O)C3=CC=C(C=C3)OC |
| Chemistry Calculators | Dilution Calculator In vivo Formulation Calculator Molarity Calculator Molecular Weight Calculator Reconstitution Calculator |
