Reaction Details |
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Target | Cruzipain |
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Ligand | BDBM50546136 |
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Substrate/Competitor | n/a |
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Meas. Tech. | ChEMBL_2014410 (CHEMBL4667988) |
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IC50 | 145000±n/a nM |
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Citation | Pereira, GAN; da Silva, EB; Braga, SFP; Leite, PG; Martins, LC; Vieira, RP; Soh, WT; Villela, FS; Costa, FMR; Ray, D; de Andrade, SF; Brandstetter, H; Oliveira, RB; Caffrey, CR; Machado, FS; Ferreira, RS Discovery and characterization of trypanocidal cysteine protease inhibitors from the 'malaria box'. Eur J Med Chem179:765-778 (2019) [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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BDBM50546136 |
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n/a |
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Name | BDBM50546136 |
Synonyms: | CHEMBL531738 |
Type | Small organic molecule |
Emp. Form. | C21H22ClN5O |
Mol. Mass. | 395.885 |
SMILES | Cn1c2ccc(CNCCNc3ccnc4cc(Cl)ccc34)cc2n(C)c1=O |
Structure |
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