Reaction Details | |||
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Target | Proteasome subunit beta type-8 | ||
Ligand | BDBM50529639 | ||
Substrate/Competitor | n/a | ||
Meas. Tech. | ChEMBL_1909301 (CHEMBL4411747) | ||
IC50 | 23±n/a nM | ||
Citation | Johnson, HWB; Lowe, E; Anderl, JL; Fan, A; Muchamuel, T; Bowers, S; Moebius, DC; Kirk, C; McMinn, DL Required Immunoproteasome Subunit Inhibition Profile for Anti-Inflammatory Efficacy and Clinical Candidate KZR-616 ((2 S,3 R)- N-(( S)-3-(Cyclopent-1-en-1-yl)-1-(( R)-2-methyloxiran-2-yl)-1-oxopropan-2-yl)-3-hydroxy-3-(4-methoxyphenyl)-2-(( S)-2-(2-morpholinoacetamido)propanamido)propenamide). J Med Chem61:11127-11143 (2018) [PubMed] Article | ||
More Info.: | Get all data from this article, Assay Method | ||
Proteasome subunit beta type-8 | |||
Name: | Proteasome subunit beta type-8 | ||
Synonyms: | 26S proteosome | LMP7 | Low molecular mass protein 7 | Macropain subunit C13 | Multicatalytic endopeptidase complex subunit C13 | PSB8_HUMAN | PSMB5i | PSMB8 | Proteasome component C13 | Proteasome subunit beta type-8 | Proteasome subunit beta-5i | RING10 | Y2 | ||
Type: | PROTEIN | ||
Mol. Mass.: | 30357.49 | ||
Organism: | Homo sapiens (Human) | ||
Description: | ChEMBL_1446797 | ||
Residue: | 276 | ||
Sequence: |
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BDBM50529639 | |||
n/a | |||
Name | BDBM50529639 | ||
Synonyms: | CHEMBL4454809 | ||
Type | Small organic molecule | ||
Emp. Form. | C32H41N3O7 | ||
Mol. Mass. | 579.6838 | ||
SMILES | COc1ccc(C[C@H](NC(=O)[C@@H](C)NC(=O)[C@H]2CC[C@H](O)CC2)C(=O)N[C@@H](Cc2ccccc2)C(=O)[C@@]2(C)CO2)cc1 |r,wU:26.27,19.19,wD:16.15,11.11,7.6,36.38,(66.97,-27.92,;66.97,-26.38,;65.64,-25.61,;64.3,-26.38,;62.97,-25.61,;62.98,-24.07,;61.64,-23.3,;61.65,-21.76,;60.31,-20.99,;58.98,-21.76,;58.98,-23.3,;57.65,-20.98,;57.65,-19.44,;56.31,-21.75,;54.98,-20.98,;54.98,-19.44,;53.64,-21.75,;52.31,-20.97,;50.98,-21.73,;50.97,-23.27,;49.63,-24.04,;52.3,-24.05,;53.65,-23.29,;62.98,-20.99,;62.98,-19.45,;64.31,-21.76,;65.65,-21,;65.65,-19.46,;66.85,-18.48,;68.28,-19.04,;69.47,-18.07,;69.23,-16.55,;67.78,-16,;66.59,-16.97,;66.98,-21.77,;66.98,-23.31,;68.31,-20.99,;69.64,-21.76,;67.53,-19.65,;69.08,-19.65,;64.3,-23.3,;65.63,-24.06,)| | ||
Structure |