Reaction Details |
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Target | Cysteine protease |
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Ligand | BDBM50318711 |
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Substrate/Competitor | n/a |
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Meas. Tech. | ChEMBL_633761 (CHEMBL1119325) |
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Ki | 400±n/a nM |
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Citation | Machon, U; Büchold, C; Stempka, M; Schirmeister, T; Gelhaus, C; Leippe, M; Gut, J; Rosenthal, PJ; Kisker, C; Leyh, M; Schmuck, C On-bead screening of a combinatorial fumaric acid derived peptide library yields antiplasmodial cysteine protease inhibitors with unusual peptide sequences. J Med Chem52:5662-72 (2009) [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 |
Synonyms: | Rhodesain |
Type: | PROTEIN |
Mol. Mass.: | 48425.78 |
Organism: | Trypanosoma brucei rhodesiense |
Description: | ChEMBL_619861 |
Residue: | 450 |
Sequence: | MPRTEMVRFVRLPVVLLAMAACLASVALGSLHVEESLEMRFAAFKKKYGKVYKDAKEEAF
RFRAFEENMEQAKIQAAANPYATFGVTPFSDMTREEFRARYRNGASYFAAAQKRLRKTVN
VTTGRAPAAVDWREKGAVTPVKDQGQCGSCWAFSTIGNIEGQWQVAGNPLVSLSEQMLVS
CDTIDFGCGGGLMDNAFNWIVNSNGGNVFTEASYPYVSGNGEQPQCQMNGHEIGAAITDH
VDLPQDEDAIAAYLAENGPLAIAVDATSFMDYNGGILTSCTSEQLDHGVLLVGYNDSSNP
PYWIIKNSWSNMWGEDGYIRIEKGTNQCLMNQAVSSAVVGGPTPPPPPPPPPSATFTQDF
CEGKGCTKGCSHATFPTGECVQTTGVGSVIATCGASNLTQIIYPLSRSCSGLSVPITVPL
DKCIPILIGSVEYHCSTNPPTKAARLVPHQ
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BDBM50318711 |
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n/a |
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Name | BDBM50318711 |
Synonyms: | (2S,15S,18S,21S,24S)-15-(2-amino-2-oxoethyl)-2-benzyl-24-carbamoyl-18-cyclohexyl-21,25-dimethyl-4,7,10,13,16,19,22-heptaoxo-3,6,9,14,17,20,23-heptaazahexacos-11-en-1-oic acid | CHEMBL1086431 |
Type | Small organic molecule |
Emp. Form. | C37H53N9O11 |
Mol. Mass. | 799.8704 |
SMILES | CC(C)[C@H](NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)\C=C\C(=O)NCC(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(O)=O)C1CCCCC1)C(N)=O |r| |
Structure |
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