| Reaction Details |
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 | Report a problem with these data |
| Target | Cysteine protease |
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| Ligand | BDBM50128345 |
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| Substrate/Competitor | n/a |
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| Meas. Tech. | ChEMBL_1523850 (CHEMBL3632411) |
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| Ki | 6810±n/a nM |
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| Citation |  Ettari, R; Pinto, A; Previti, S; Tamborini, L; Angelo, IC; La Pietra, V; Marinelli, L; Novellino, E; Schirmeister, T; Zappalą, M; Grasso, S; De Micheli, C; Conti, P Development of novel dipeptide-like rhodesain inhibitors containing the 3-bromoisoxazoline warhead in a constrained conformation. Bioorg Med Chem23:7053-60 (2015) [PubMed] Article |
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| More Info.: | Get all data from this article, Assay Method |
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| Cysteine protease |
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| Name: | Cysteine protease |
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| Synonyms: | Rhodesain |
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| Type: | PROTEIN |
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| Mol. Mass.: | 48425.78 |
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| Organism: | Trypanosoma brucei rhodesiense |
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| Description: | ChEMBL_619861 |
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| Residue: | 450 |
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| Sequence: | MPRTEMVRFVRLPVVLLAMAACLASVALGSLHVEESLEMRFAAFKKKYGKVYKDAKEEAF
RFRAFEENMEQAKIQAAANPYATFGVTPFSDMTREEFRARYRNGASYFAAAQKRLRKTVN
VTTGRAPAAVDWREKGAVTPVKDQGQCGSCWAFSTIGNIEGQWQVAGNPLVSLSEQMLVS
CDTIDFGCGGGLMDNAFNWIVNSNGGNVFTEASYPYVSGNGEQPQCQMNGHEIGAAITDH
VDLPQDEDAIAAYLAENGPLAIAVDATSFMDYNGGILTSCTSEQLDHGVLLVGYNDSSNP
PYWIIKNSWSNMWGEDGYIRIEKGTNQCLMNQAVSSAVVGGPTPPPPPPPPPSATFTQDF
CEGKGCTKGCSHATFPTGECVQTTGVGSVIATCGASNLTQIIYPLSRSCSGLSVPITVPL
DKCIPILIGSVEYHCSTNPPTKAARLVPHQ
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| BDBM50128345 |
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| n/a |
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| Name | BDBM50128345 |
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| Synonyms: | CHEMBL3629346 |
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| Type | Small organic molecule |
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| Emp. Form. | C23H23BrN4O6 |
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| Mol. Mass. | 531.356 |
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| SMILES | [H][C@@]12CN(C[C@]1([H])C(Br)=NO2)C(=O)[C@H](CCc1ccccc1)NC(=O)OCc1ccc(cc1)[N+]([O-])=O |r,c:9| |
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| Structure | 
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