NVP-DKY709   Click here for help

GtoPdb Ligand ID: 12583

Synonyms: compound 5 [PMID: 36863346] | DKY-709 | DKY709
PDB Ligand
Compound class: Synthetic organic
Comment: NVP-DKY709 is a molecular glue type degrader, that promotes selective cereblon-mediated degradation of the IKZF2 ('Helios') transcription factor (IKZF2; Q9UKS7) [1]. It has no effect on IKZF1 (Ikaros) or IKZF3 (Aiolos). NVP-DKY709 is intended as a cancer immunotherapy agent that reduces regulatory T cell suppression, with the aim of re-establishing an anti-tumour immune response in the tumour microenvironment.
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2D Structure
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Physico-chemical Properties
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Hydrogen bond acceptors 6
Hydrogen bond donors 1
Rotatable bonds 4
Topological polar surface area 69.72
Molecular weight 417.5
XLogP 0.8
No. Lipinski's rules broken 0
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Canonical SMILES C1=CC=C(C=C1)CN2CCC(CC2)C3=CC=C4C(=C3)CN(C5CCC(=O)NC5=O)C4=O
Isomeric SMILES C1CC(=O)NC(=O)C1N2CC3=C(C2=O)C=CC(=C3)C4CCN(CC4)CC5=CC=CC=C5
InChI InChI=1S/C25H27N3O3/c29-23-9-8-22(24(30)26-23)28-16-20-14-19(6-7-21(20)25(28)31)18-10-12-27(13-11-18)15-17-4-2-1-3-5-17/h1-7,14,18,22H,8-13,15-16H2,(H,26,29,30)
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
compound 5 [PMID: 36863346] | DKY-709 | DKY709
Database Links Click here for help
CAS Registry No. 2291360-73-9 (source: PubChem)
ChEMBL Ligand CHEMBL5077506
GtoPdb PubChem SID 479821373
PubChem CID 137519326
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