PPIPT02488

Target Protein Information
Protein_Name Catenin beta-1
Protein_Sequence MATQADLMELDMAMEPDRKAAVSHWQQQSYLDSGIHSGATTTAPSLSGKGNPEEEDVDTSQVLYEWEQGFSQSFTQEQVADIDGQYAMTRAQRVRAAMFPETLDEGMQIPSTQFDAAHPTNVQRLAEPSQMLKHAVVNLINYQDDAELATRAIPELTKLLNDEDQVVVNKAAVMVHQLSKKEASRHAIMRSPQMVSAIVRTMQNTNDVETARCTAGTLHNLSHHREGLLAIFKSGGIPALVKMLGSPVDSVLFYAITTLHNLLLHQEGAKMAVRLAGGLQKMVALLNKTNVKFLAITTDCLQILAYGNQESKLIILASGGPQALVNIMRTYTYEKLLWTTSRVLKVLSVCSSNKPAIVEAGGMQALGLHLTDPSQRLVQNCLWTLRNLSDAATKQEGMEGLLGTLVQLLGSDDINVVTCAAGILSNLTCNNYKNKMMVCQVGGIEALVRTVLRAGDREDITEPAICALRHLTSRHQEAEMAQNAVRLHYGLPVVVKLLHPPSHWPLIKATVGLIRNLALCPANHAPLREQGAIPRLVQLLVRAHQDTQRRTSMGGTQQQFVEGVRMEEIVEGCTGALHILARDVHNRIVIRGLNTIPLFVQLLYSPIENIQRVAAGVLCELAQDKEAAEAIEAEGATAPLTELLHSRNEGVATYAAAVLFRMSEDKPQDYKKRLSVELTSSLFRTEPMAWNETADLGLDIGAQGEPLGYRQDDPSYRSFHSGGYGQDALGMDPMMEHEMGGHHPGADYPVDGLPDLGHAQDLMDGLPPGDSNQLAWFDTDL
Organism_Source Homo sapiens
Functional_Classification Transcriptional co-activator (Wnt signaling pathway)
Cellular_Localization Cytoplasm
Gene_Names CTNNB1
UniProt_ID P35222
Protein-Protein Interaction Networks
Peptide Basic Information
Peptide_Name WX-024
Peptide_Sequence LQTLXIQRXL
Peptide_Length 10
Peptide_SMILES CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](N)CC(C)C)[C@@H](C)O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)O
Chemical_Modification X5=(S)-2-(4'-pentenyl)alanine; X9=(S)-2-(4'-pentenyl)alanine
Cyclization_Method Main chain-main chain cyclization; X5<-->X9; other bonds
Linear/Cyclic Cyclic
N-terminal_Modification acetyl
C-terminal_Modification 2-Naphthylalanine-NH2
Amino_Acid_Distribution
Peptide Physicochemical
Molecular_Weight 1098.31
Aliphatic_Index 156.00000
Aromaticity 0.00000
Average_Rotatable_Bonds 3.80000
Charge_at_pH_7 0.99798
Isoelectric_point 10.55000
Hydrogen_Bond_Acceptors 15
Hydrogen_Bond_Donors 17
Topological_Polar_Surface_Area 493.53000
X_logP_energy -4.61623
Interaction Information
Affinity IC50=191 nM
Affinity_Assay flourescence beta-lactamase reporter assay
PDB_ID None
Type Inhibitor
Structure
Reference Information
Document_Type Patent
Title STABILIZED BCL9 PEPTIDES FOR TREATMENT OF ABERRANT WNT SIGNALING
Release_Year 2021
Patent_ID US20210292385A1