EN67   Click here for help

GtoPdb Ligand ID: 12637

Synonyms: EN-67
Compound class: Synthetic organic
Comment: EN67 is a molecular glue type protein degrader [1]. It is a derivative of EN450, and like its predecsor EN67 forms a covalent bond with the allosteric C111 residue on UBE2D E2 ubiquitin-conjugating enzymes. Direct interaction with the UBE2D2 isozyme has been demonstrated.

EN67 has been conjudated to the BRD4 inhibitor (+)-JQ1, to generate a PROTAC class degrader (named NF90), which demonstrates that E2 ubiquitin ligase components can be recruited by such molecules to promote degradation of neo-substrates, in addition to the many previously reported recruiters that target E3 components of the ubiquitin-proteasome system.
2D Structure
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Physico-chemical Properties
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Hydrogen bond acceptors 3
Hydrogen bond donors 1
Rotatable bonds 6
Topological polar surface area 59.92
Molecular weight 278.28
XLogP 1.25
No. Lipinski's rules broken 0
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Canonical SMILES C=CC(=O)NCC1CC(=NO1)C2=CC(=C(C=C2)OC)F
InChI InChI=1S/C14H15FN2O3/c1-3-14(18)16-8-10-7-12(17-20-10)9-4-5-13(19-2)11(15)6-9/h3-6,10H,1,7-8H2,2H3,(H,16,18)
Classification Click here for help
Compound class Synthetic organic
Ligand families/groups PROTACs, molecular glues and other degraders
IUPAC Name Click here for help
Synonyms Click here for help
Database Links Click here for help
GtoPdb PubChem SID 479821427
PubChem CID 132362390
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