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form
solid (powder or film on well wall)
Quality Level
reaction suitability
reagent type: ligand
concentration
125 μg/well
suitability
suitable for H-NMR
suitable for LC-MS
storage temp.
2-8°C
Application
Based on the SAR rules outlined in IAP antagonist research, the binding tetrapeptide anchor of the natural SMAC inhibitor protein of IAPs (AVPI and AVPF) was used in identification of novel derivatives designed by 3D similarity.
The initial library was filtered via in silico IFD methods by docking to the BIR3 domain of the IAP crystal structures. The highest binding derivatives were selected and collected in a screening library, including the natural binding tetrapeptides and known MV1 reference compounds. IAP in silico leads are an optimal collection to begin IAP lead discovery at the bench for eventual development into bifunctional protein degraders. With the proper assay setup to measure protein degradation or protein-protein interactions (PPIs), the ComInnex IAP Ligand Library can also be a platform for molecular glue discovery.
Learn more about this library: Accelerating IAP Lead Discovery for Targeted Protein Degradation
To view a complete list of compounds in the library, including sdf, visit the CIX001 Plate Map.
To streamline the assessment of these in silico leads for target-specific bifunctional degraders, three IAP ligands with the highest docking scores were also prepared as degrader building blocks for simple attachment of a target warhead.
Biochem/physiol Actions
related product
Storage Class Code
11 - Combustible Solids
WGK
WGK 3
Regulatory Listings
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