| Reaction Details |
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 | Report a problem with these data |
| Target | Nonstructural protein 5A |
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| Ligand | BDBM50547643 |
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| Substrate/Competitor | n/a |
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| Meas. Tech. | ChEMBL_2018865 (CHEMBL4672443) |
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| IC50 | 0.002±n/a nM |
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| Citation |  Ivashchenko, AA; Ivanenkov, YA; Aladinskiy, VA; Karapetian, RN; Koryakova, AG; Ryakhovskiy, AA; Mitkin, OD; Kravchenko, DV; Savchuk, NP; Zagribelnyy, BA; Ivashchenko, AV Synthesis, biological evaluation and in silico modeling of novel pan-genotypic NS5A inhibitors. Bioorg Med Chem28:0 (2020) [PubMed] Article |
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| More Info.: | Get all data from this article, Assay Method |
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| Nonstructural protein 5A |
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| Name: | Nonstructural protein 5A |
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| Synonyms: | NS5A | Nonstructural protein 5A |
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| Type: | PROTEIN |
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| Mol. Mass.: | 48587.20 |
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| Organism: | Hepatitis C virus |
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| Description: | ChEMBL_108438 |
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| Residue: | 447 |
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| Sequence: | SGSWLRDVWDWICTVLTDFKTWLQSKLLPRIPGVPFLSCQRGYKGVWRGDGIMHTTCPCG
AQITGHVKNGSMRIVGPKTCSNTWHGTFPINTYTTGPCTPSPAPNYSRALWRVAAEEYVE
VTRVGDFHYVTGMTTDNVKCPCQVPAPEFFTEVDGVRLHRYAPACKPLLREEVTFMVGLN
QYLVGSQLPCEPEPDVTVLTSMLTDPSHITAETAGRRLARGSPPSLASSSASQLSAPSLK
ATCTTRHDSPDADLIEANLLWRQEMGGNITRVESENKVVILDSFDPLQAEEDEREVSVPA
EILRKSRKFPRAMPIWARPDYNPPLLESWKDPDYVPPVVHGCPLPPAKAPPIPPPRRKRT
VVLTESTVSSALAELATKTFGSSGSSAVDSGTATAPPDQLPGDGDSGSDVESYSSMPPLE
GEPGDPDLSDGSWSTMSEEASEDVVCC
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| BDBM50547643 |
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| n/a |
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| Name | BDBM50547643 |
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| Synonyms: | CHEMBL4764688 |
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| Type | Small organic molecule |
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| Emp. Form. | C53H54Cl2N8O6 |
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| Mol. Mass. | 969.952 |
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| SMILES | Cl.Cl.COC(=O)N[C@@H](C(C)C)C(=O)N1CCC[C@H]1c1ncc([nH]1)-c1ccc(C#CC#Cc2cnc([nH]2)[C@@H]2CCCN2C(=O)[C@H](NC(=O)OC)c2ccccc2)c(c1)-c1ccc(cc1)-c1ccccc1 |r| |
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| Structure | 
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