Reaction Details |
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Target | Cruzipain |
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Ligand | BDBM50514688 |
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Substrate/Competitor | n/a |
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Meas. Tech. | ChEMBL_1858190 (CHEMBL4358919) |
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Ki | 370±n/a nM |
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Citation | Chenna, BC; Li, L; Mellott, DM; Zhai, X; Siqueira-Neto, JL; Calvet Alvarez, C; Bernatchez, JA; Desormeaux, E; Alvarez Hernandez, E; Gomez, J; McKerrow, JH; Cruz-Reyes, J; Meek, TD Peptidomimetic Vinyl Heterocyclic Inhibitors of Cruzain Effect Antitrypanosomal Activity. J Med Chem63:3298-3316 (2020) [PubMed] Article |
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More Info.: | Get all data from this article, Assay Method |
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Cruzipain |
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Name: | Cruzipain |
Synonyms: | CYSP_TRYCR | Cruzain | Cruzaine | Major cysteine proteinase |
Type: | Protein |
Mol. Mass.: | 49831.41 |
Organism: | Trypanosoma cruzi |
Description: | P25779 |
Residue: | 467 |
Sequence: | MSGWARALLLAAVLVVMACLVPAATASLHAEETLTSQFAEFKQKHGRVYESAAEEAFRLS
VFRENLFLARLHAAANPHATFGVTPFSDLTREEFRSRYHNGAAHFAAAQERARVPVKVEV
VGAPAAVDWRARGAVTAVKDQGQCGSCWAFSAIGNVECQWFLAGHPLTNLSEQMLVSCDK
TDSGCSGGLMNNAFEWIVQENNGAVYTEDSYPYASGEGISPPCTTSGHTVGATITGHVEL
PQDEAQIAAWLAVNGPVAVAVDASSWMTYTGGVMTSCVSEQLDHGVLLVGYNDSAAVPYW
IIKNSWTTQWGEEGYIRIAKGSNQCLVKEEASSAVVGGPGPTPEPTTTTTTSAPGPSPSY
FVQMSCTDAACIVGCENVTLPTGQCLLTTSGVSAIVTCGAETLTEEVFLTSTHCSGPSVR
SSVPLNKCNRLLRGSVEFFCGSSSSGRLADVDRQRRHQPYHSRHRRL
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BDBM50514688 |
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n/a |
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Name | BDBM50514688 |
Synonyms: | CHEMBL4590860 |
Type | Small organic molecule |
Emp. Form. | C33H31N3O5 |
Mol. Mass. | 549.6163 |
SMILES | [O-][N+](=O)c1ccc(\C=C\[C@H](Cc2ccccc2)NC(=O)[C@H](Cc2ccccc2)NC(=O)OCc2ccccc2)cc1 |r| |
Structure |
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