Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BACE1 | P56817 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | PDE7A | Q13946 | 1/20 | 0.38 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.36 |
| ▸ | PDK4 | Q16654 | 1/20 | 0.36 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.36 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.36 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 2/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | KDM1A | O60341 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.33 |
| ▸ | HTR5A | P47898 | 1/20 | 0.33 |
| ▸ | HTR2A | P28223 | 3/20 | 0.33 |
| ▸ | HTR1A | P08908 | 2/20 | 0.33 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL7004720 | 0.90 | PDE7A (0.46) | BACE1MEN1KMT2APDE7AOPRM1 | |
| SCHEMBL20437948 | 0.80 | CYP2D6 (0.53) | BACE1MEN1KMT2AOPRM1OPRK1 | |
| SCHEMBL29622026 | 0.74 | BACE1 (0.68) | BACE1MEN1KMT2APDE7APDK2 | |
| SCHEMBL318668 | 0.74 | BACE1 (0.68) | BACE1MEN1KMT2APDE7APDK2 | |
| SCHEMBL30483844 | 0.73 | PDE7A (0.48) | BACE1MEN1KMT2APDE7APDK2 | |
| SCHEMBL30242138 | 0.71 | PDK2 (0.57) | MEN1KMT2APDK2PDK4GAA | |
| SCHEMBL844744 | 0.71 | PDK2 (0.57) | MEN1KMT2APDK2PDK4GAA | |
| SCHEMBL13827560 | 0.71 | PDE7A (0.52) | BACE1MEN1KMT2APDE7APDK2 | |
| SCHEMBL22296289 | 0.70 | MAPK1 (0.35) | BACE1LMNAMAPK1ALDH1A1HTR2A | |
| SCHEMBL13686012 | 0.69 | HTR5A (0.34) | HTR5A |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2021129799-A1 | INFLUENZA VIRUS REPLICATION INHIBITOR AND USE THEREOF | 广东东阳光药业有限公司 | 2021-07-01 | — | — | WO | disclosed |