Reaction Details |
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Target | Falcipain 2 |
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Ligand | BDBM50183402 |
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Substrate/Competitor | n/a |
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Meas. Tech. | ChEMBL_336664 (CHEMBL859281) |
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IC50 | 14300±n/a nM |
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Citation | Desai, PV; Patny, A; Gut, J; Rosenthal, PJ; Tekwani, B; Srivastava, A; Avery, M Identification of novel parasitic cysteine protease inhibitors by use of virtual screening. 2. The available chemical directory. J Med Chem49:1576-84 (2006) [PubMed] Article |
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More Info.: | Get all data from this article, Assay Method |
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Falcipain 2 |
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Name: | Falcipain 2 |
Synonyms: | Cysteine protease falcipain-2 | Falcipain 2 | Falcipain-2 |
Type: | Enzyme |
Mol. Mass.: | 55912.60 |
Organism: | Plasmodium falciparum |
Description: | Recombinant falcipain-2. |
Residue: | 484 |
Sequence: | MDYNMDYAPHEVISQQGERFVDKYVDRKILKNKKSLLVIISLSVLSVVGFVLFYFTPNSR
KSDLFKNSSVENNNDDYIINSLLKSPNGKKFIVSKIDEALSFYDSKKNDINKYNEGNNNN
NADFKGLSLFKENTPSNNFIHNKDYFINFFDNKFLMNNAEHINQFYMFIKTNNKQYNSPN
EMKERFQVFLQNAHKVNMHNNNKNSLYKKELNRFADLTYHEFKNKYLSLRSSKPLKNSKY
LLDQMNYEEVIKKYRGEENFDHAAYDWRLHSGVTPVKDQKNCGSCWAFSSIGSVESQYAI
RKNKLITLSEQELVDCSFKNYGCNGGLINNAFEDMIELGGICPDGDYPYVSDAPNLCNID
RCTEKYGIKNYLSVPDNKLKEALRFLGPISISVAVSDDFAFYKEGIFDGECGDQLNHAVM
LVGFGMKEIVNPLTKKGEKHYYYIIKNSWGQQWGERGFINIETDESGLMRKCGLGTDAFI
PLIE
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BDBM50183402 |
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n/a |
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Name | BDBM50183402 |
Synonyms: | CHEMBL205056 | methyl 2-(2-(4-(4-chlorophenylsulfonyl)piperazin-1-yl)acetamido)thiophene-3-carboxylate |
Type | Small organic molecule |
Emp. Form. | C18H20ClN3O5S2 |
Mol. Mass. | 457.952 |
SMILES | COC(=O)c1ccsc1NC(=O)CN1CCN(CC1)S(=O)(=O)c1ccc(Cl)cc1 |
Structure |
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