VHL-ligand-1 20μM R07 exp421
Mechanism of Action
Binds VHL, targeting moiety for PROTACs
- Class / Subclass 1: Proteostasis / Bivalent Ligand
Technical Notes
Compound References
- PubChem Name: Protein degrader 1 hydrochloride
- Synonyms: N/A
- CAS #: 1448189-80-7
- PubChem CID: 118864076
- IUPAC: (2S,4R)-1-[(2S)-2-amino-3,3-dimethylbutanoyl]-4-hydroxy-N-[[4-(4-methyl-1,3-thiazol-5-yl)phenyl]methyl]pyrrolidine-2-carboxamide;hydrochloride
- INCHI Name: InChI=1S/C22H30N4O3S.ClH/c1-13-18(30-12-25-13)15-7-5-14(6-8-15)10-24-20(28)17-9-16(27)11-26(17)21(29)19(23)22(2,3)4;/h5-8,12,16-17,19,27H,9-11,23H2,1-4H3,(H,24,28);1H/t16-,17+,19-;/m1./s1
- INCHI Key: JYRTWGCWUBURGU-MSSRUXLCSA-N
- Molecular Weight: 467
- Canonical SMILES: CC1=C(SC=N1)C2=CC=C(C=C2)CNC(=O)C3CC(CN3C(=O)C(C(C)(C)C)N)O.Cl
- Isomeric SMILES: CC1=C(SC=N1)C2=CC=C(C=C2)CNC(=O)[C@@H]3C[C@H](CN3C(=O)[C@H](C(C)(C)C)N)O.Cl
- Molecular Formula: C22H31ClN4O3S
Compound Supplier
- Supplier Name: Cayman Chemical
- Catalog #: 21591
- Lot #: 0505579-1
Compound Characterization
- HRMS (ESI-TOF) m/z: (M+H)+ Calcd for C22 H30 N4 O3 S 431.21114; found 431.21176
Dose Response Curve
- Platform ID: VHL_Ligand_1
- Min: -13.9762; Max: 12.9391
| IC | Concentration (µM) |
|---|---|
| IC10 | N/A |
| IC20 | N/A |
| IC30 | N/A |
| IC40 | N/A |
| IC50 | N/A |
| IC60 | N/A |
| IC70 | N/A |
| IC80 | N/A |
| IC90 | N/A |
Screen Summary
- Round: 07
- Dose: 20µM
- Days of incubation: 8
- Doublings: 7.0
- Numbers of reads: 18199347
Screen Results
| Sensitive/Resistant hits (FDR<0.05) | CRANKS | Score Plot | Top 30 Genes | Screen Similarity | Top 30 Sensitive GO terms | Top 30 Resistant GO terms |
|---|---|---|---|---|---|---|
| 0/0 | Scores |