| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 16th, 2008 | 23 | No |
Popular Name: Relenza Relenza
| Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
|---|---|---|---|---|---|---|---|---|---|---|
| Ref Reference (pH 7) | -3.64 | -6.67 | -67.62 | 9 | 11 | 0 | 205 | 332.313 | 6 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| ALOGPS_SOLUBILITY | 7.31e+00 g/l | DrugBank-approved |
| Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| A8K327-1-E | Sialidase 3 (cluster #1 Of 2), Eukaryotic | Eukaryotes | 5 | 0.51 | Binding ≤ 10μM |
| NEUR1-1-E | Sialidase 1 (cluster #1 Of 2), Eukaryotic | Eukaryotes | 5 | 0.51 | Binding ≤ 10μM |
| NEUR2-1-E | Sialidase 2 (cluster #1 Of 2), Eukaryotic | Eukaryotes | 5 | 0.51 | Binding ≤ 10μM |
| NEUR3-1-E | Sialidase-3 (cluster #1 Of 1), Eukaryotic | Eukaryotes | 7000 | 0.31 | Binding ≤ 10μM |
| NEUR4-1-E | Sialidase 4 (cluster #1 Of 1), Eukaryotic | Eukaryotes | 2300 | 0.34 | Binding ≤ 10μM |
| Z50523-1-O | Influenza B Virus (cluster #1 Of 1), Other | Other | 4 | 0.51 | Binding ≤ 10μM |
| Z50652-1-O | Influenza A Virus (cluster #1 Of 1), Other | Other | 5 | 0.51 | Binding ≤ 10μM |
| Z100811-1-O | Influenza A Virus (H5N1) (cluster #1 Of 1), Other | Other | 2800 | 0.34 | Functional ≤ 10μM |
| Z101821-1-O | H2N2 Subtype (cluster #1 Of 3), Other | Other | 760 | 0.37 | Functional ≤ 10μM |
| Z101822-1-O | H3N2 Subtype (cluster #1 Of 2), Other | Other | 680 | 0.38 | Functional ≤ 10μM |
| Z50142-2-O | Influenza A Virus (A/PR/8/34(H1N1)) (cluster #2 Of 2), Other | Other | 11 | 0.48 | Functional ≤ 10μM |
| Z50523-1-O | Influenza B Virus (cluster #1 Of 1), Other | Other | 9 | 0.49 | Functional ≤ 10μM |
| Z50652-1-O | Influenza A Virus (cluster #1 Of 4), Other | Other | 90 | 0.43 | Functional ≤ 10μM |
| Z80249-1-O | MDCK (Kidney Cells) (cluster #1 Of 2), Other | Other | 40 | 0.45 | Functional ≤ 10μM |
| A5Z252-1-V | Neuraminidase (cluster #1 Of 1), Viral | Viruses | 1 | 0.55 | Binding ≤ 10μM |
| B4URF0-1-V | Neuraminidase (cluster #1 Of 1), Viral | Viruses | 4 | 0.51 | Binding ≤ 10μM |
| C4LRQ6-1-V | Neuraminidase (cluster #1 Of 1), Viral | Viruses | 1 | 0.55 | Binding ≤ 10μM |
| NRAM-1-V | Neuraminidase (cluster #1 Of 2), Viral | Viruses | 3 | 0.52 | Binding ≤ 10μM |
| Q2LFS1-1-V | Neuraminidase (cluster #1 Of 1), Viral | Viruses | 1 | 0.55 | Binding ≤ 10μM |
| Q6Q793-1-V | Neuraminidase (cluster #1 Of 1), Viral | Viruses | 1 | 0.55 | Binding ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| Z50652 | Z50652 | Influenza A Virus | 5 | 0.51 | Binding ≤ 1μM |
| Z50523 | Z50523 | Influenza B Virus | 4 | 0.51 | Binding ≤ 1μM |
| NRAM_I68A0 | Q75VQ4 | Neuraminidase, I68a0 | 2.66 | 0.52 | Binding ≤ 1μM |
| Q6Q793_9INFA | Q6Q793 | Neuraminidase, 9infa | 0.5 | 0.57 | Binding ≤ 1μM |
| Q2LFS1_9INFA | Q2LFS1 | Neuraminidase, 9infa | 0.4 | 0.57 | Binding ≤ 1μM |
| NRAM_INBLE | P03474 | Neuraminidase, Inble | 0.1 | 0.61 | Binding ≤ 1μM |
| NRAM_I34A1 | P03468 | Neuraminidase, I34a1 | 1 | 0.55 | Binding ≤ 1μM |
| C4LRQ6_9INFA | C4LRQ6 | Neuraminidase, 9infa | 0.5 | 0.57 | Binding ≤ 1μM |
| B4URF0_9INFA | B4URF0 | Neuraminidase, 9infa | 2.4 | 0.52 | Binding ≤ 1μM |
| A5Z252_9INFA | A5Z252 | Neuraminidase, 9infa | 1 | 0.55 | Binding ≤ 1μM |
| NEUR1_HUMAN | Q99519 | Sialidase 1, Human | 1 | 0.55 | Binding ≤ 1μM |
| NEUR2_HUMAN | Q9Y3R4 | Sialidase 2, Human | 1 | 0.55 | Binding ≤ 1μM |
| A8K327_HUMAN | A8K327 | Sialidase 3, Human | 1 | 0.55 | Binding ≤ 1μM |
| Z50652 | Z50652 | Influenza A Virus | 5 | 0.51 | Binding ≤ 10μM |
| Z50523 | Z50523 | Influenza B Virus | 4 | 0.51 | Binding ≤ 10μM |
| B4URF0_9INFA | B4URF0 | Neuraminidase, 9infa | 2.4 | 0.52 | Binding ≤ 10μM |
| A5Z252_9INFA | A5Z252 | Neuraminidase, 9infa | 1 | 0.55 | Binding ≤ 10μM |
| NRAM_I68A0 | Q75VQ4 | Neuraminidase, I68a0 | 2.66 | 0.52 | Binding ≤ 10μM |
| Q6Q793_9INFA | Q6Q793 | Neuraminidase, 9infa | 0.5 | 0.57 | Binding ≤ 10μM |
| Q2LFS1_9INFA | Q2LFS1 | Neuraminidase, 9infa | 0.4 | 0.57 | Binding ≤ 10μM |
| NRAM_INBLE | P03474 | Neuraminidase, Inble | 0.1 | 0.61 | Binding ≤ 10μM |
| NRAM_I34A1 | P03468 | Neuraminidase, I34a1 | 1 | 0.55 | Binding ≤ 10μM |
| C4LRQ6_9INFA | C4LRQ6 | Neuraminidase, 9infa | 0.5 | 0.57 | Binding ≤ 10μM |
| NEUR1_HUMAN | Q99519 | Sialidase 1, Human | 1 | 0.55 | Binding ≤ 10μM |
| NEUR2_HUMAN | Q9Y3R4 | Sialidase 2, Human | 1 | 0.55 | Binding ≤ 10μM |
| A8K327_HUMAN | A8K327 | Sialidase 3, Human | 1 | 0.55 | Binding ≤ 10μM |
| NEUR4_HUMAN | Q8WWR8 | Sialidase 4, Human | 2300 | 0.34 | Binding ≤ 10μM |
| NEUR3_HUMAN | Q9UQ49 | Sialidase-3, Human | 6800 | 0.31 | Binding ≤ 10μM |
| Z101821 | Z101821 | H2N2 Subtype | 0.79 | 0.55 | Functional ≤ 10μM |
| Z101822 | Z101822 | H3N2 Subtype | 1.6 | 0.54 | Functional ≤ 10μM |
| Z50652 | Z50652 | Influenza A Virus | 0.3 | 0.58 | Functional ≤ 10μM |
| Z50142 | Z50142 | Influenza A Virus (A/PR/8/34(H1N1)) | 10 | 0.49 | Functional ≤ 10μM |
| Z100811 | Z100811 | Influenza A Virus (H5N1) | 0.79 | 0.55 | Functional ≤ 10μM |
| Z50523 | Z50523 | Influenza B Virus | 100 | 0.43 | Functional ≤ 10μM |
| Z80249 | Z80249 | MDCK (Kidney Cells) | 2800 | 0.34 | Functional ≤ 10μM |
| Description | Species |
|---|---|
| Assembly of Viral Components at the Budding Site | |
| Budding | |
| Entry of Influenza Virion into Host Cell via Endocytosis | |
| Fusion of the Influenza Virion to the Host Cell Endosome | |
| Glycosphingolipid metabolism | |
| Influenza Life Cycle | |
| Influenza Virus Induced Apoptosis | |
| Packaging of Eight RNA Segments | |
| Release | |
| Sialic acid metabolism | |
| Transport of HA trimer, NA tetramer and M2 tetramer from the endoplasmic reticul | |
| Uncoating of the Influenza Virion | |
| Viral mRNA Translation |
