| Reaction Details |
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 | Report a problem with these data |
| Target | Gag-Pol polyprotein [489-587] |
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| Ligand | BDBM50200953 |
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| Substrate/Competitor | n/a |
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| Meas. Tech. | ChEMBL_422734 (CHEMBL854830) |
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| Ki | 28±n/a nM |
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| Citation |  Whiting, M; Tripp, JC; Lin, YC; Lindstrom, W; Olson, AJ; Elder, JH; Sharpless, KB; Fokin, VV Rapid discovery and structure-activity profiling of novel inhibitors of human immunodeficiency virus type 1 protease enabled by the copper(I)-catalyzed synthesis of 1,2,3-triazoles and their further functionalization. J Med Chem49:7697-710 (2006) [PubMed] Article |
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| More Info.: | Get all data from this article, Assay Method |
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| |
| Gag-Pol polyprotein [489-587] |
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| Name: | Gag-Pol polyprotein [489-587] |
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| Synonyms: | Human immunodeficiency virus type 1 protease | POL_HV1H2 | Pol polyprotein | gag-pol |
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| Type: | Enzyme Subunit |
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| Mol. Mass.: | 10781.16 |
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| Organism: | Human immunodeficiency virus type 1 |
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| Description: | P04585[489-587] |
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| Residue: | 99 |
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| Sequence: | PQVTLWQRPLVTIKIGGQLKEALLDTGADDTVLEEMSLPGRWKPKMIGGIGGFIKVRQYD
QILIEICGHKAIGTVLVGPTPVNIIGRNLLTQIGCTLNF
|
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|
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| BDBM50200953 |
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| n/a |
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| Name | BDBM50200953 |
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| Synonyms: | CHEMBL405393 | cyclopentyl (2S,3S)-3-(4-((4-(5-chloro-2-methylphenyl)piperazin-1-yl)methyl)-5-((R)1-hydroxyethyl)-1H-1,2,3-triazol-1-yl)-1,4-diphenylbutan-2-ylcarbamate |
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| Type | Small organic molecule |
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| Emp. Form. | C38H47ClN6O3 |
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| Mol. Mass. | 671.271 |
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| SMILES | C[C@@H](O)c1c(CN2CCN(CC2)c2cc(Cl)ccc2C)nnn1[C@@H](Cc1ccccc1)[C@H](Cc1ccccc1)NC(=O)OC1CCCC1 |r| |
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| Structure | 
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