Reaction Details |
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Target | Genome polyprotein |
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Ligand | BDBM50112656 |
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Substrate/Competitor | n/a |
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Meas. Tech. | ChEMBL_161086 (CHEMBL771547) |
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EC50 | 600±n/a nM |
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Citation | Johnson, TO; Hua, Y; Luu, HT; Brown, EL; Chan, F; Chu, SS; Dragovich, PS; Eastman, BW; Ferre, RA; Fuhrman, SA; Hendrickson, TF; Maldonado, FC; Matthews, DA; Meador, JW; Patick, AK; Reich, SH; Skalitzky, DJ; Worland, ST; Yang, M; Zalman, LS Structure-based design of a parallel synthetic array directed toward the discovery of irreversible inhibitors of human rhinovirus 3C protease. J Med Chem45:2016-23 (2002) [PubMed] |
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More Info.: | Get all data from this article, Assay Method |
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Genome polyprotein |
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Name: | Genome polyprotein |
Synonyms: | Human rhinovirus A protease | Human rhinovirus B 3A protease |
Type: | PROTEIN |
Mol. Mass.: | 44361.04 |
Organism: | Human rhinovirus B |
Description: | ChEMBL_158953 |
Residue: | 401 |
Sequence: | AFRPCNVNTKIGNAKCCPFVCGKAVTFKDRSTCSTYNLSSSLHHILEEDKRRRQVVDVMS
AIFQGPISLDAPPPPAIADLLQSVRTPRVIKYCQIIMGHPAECQVERDLNIANSIIAIIA
NIISIAGIIFVIYKLFCSLQGPYSGEPKPKTKVPERRVVAQGPEEEFGRSILKNNTCVIT
TGNGKFTGLGIHDRILIIPTHADPGREVQVNGVHTKVLDSYDLYNRDGVKLEITVIQLDR
NEKFRDIRKYIPETEDDYPECNLALSANQDEPTIIKVGDVVSYGNILLSGNQTARMLKYN
YPTKSGYCGGVLYKIGQILGIHVGGNGRDGFSAMLLRSYFTGQIKVNKHATECGLPDIQT
IHTPSKTKLQPSVFYDVFPGSKEPAVLTDNDPRLEVNFKEA
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BDBM50112656 |
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n/a |
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Name | BDBM50112656 |
Synonyms: | 4-[2-(2-Benzyloxycarbonylamino-4-methyl-pentanoylamino)-3-phenyl-propionylamino]-6-carbamoyl-hex-2-enoic acid ethyl ester | CHEMBL305321 |
Type | Small organic molecule |
Emp. Form. | C32H42N4O7 |
Mol. Mass. | 594.6985 |
SMILES | CCOC(=O)\C=C\[C@H](CCC(N)=O)NC(=O)C(Cc1ccccc1)NC(=O)[C@H](CC(C)C)NC(=O)OCc1ccccc1 |
Structure |
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