Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 12/20 | 0.48 |
| ▸ | MAPT | P10636 | 11/20 | 0.48 |
| ▸ | NPSR1 | Q6W5P4 | 4/20 | 0.48 |
| ▸ | HTT | P42858 | 2/20 | 0.48 |
| ▸ | LMNA | P02545 | 6/20 | 0.47 |
| ▸ | HPGD | P15428 | 5/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.47 |
| ▸ | TLR9 | Q9NR96 | 2/20 | 0.47 |
| ▸ | MITF | O75030 | 1/20 | 0.47 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.47 |
| ▸ | PKM | P14618 | 1/20 | 0.47 |
| ▸ | RAB9A | P51151 | 7/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 6/20 | 0.47 |
| ▸ | NPC1 | O15118 | 5/20 | 0.47 |
| ▸ | S1PR4 | O95977 | 3/20 | 0.47 |
| ▸ | ITGA4 | P13612 | 1/20 | 0.47 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.47 |
| ▸ | NOD2 | Q9HC29 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 3/20 | 0.46 |
| ▸ | POLB | P06746 | 3/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL3072548 | 1.00 | ALDH1A1 (0.48) | ALDH1A1MAPTNPSR1HTTLMNA | |
| SCHEMBL16900169 | 0.87 | ALDH1A1 (0.62) | ALDH1A1MAPTNPSR1HTTLMNA | |
| SCHEMBL15529186 | 0.87 | ALDH1A1 (0.47) | ALDH1A1MAPTNPSR1HTTLMNA | |
| SCHEMBL3829296 | 0.85 | ALDH1A1 (0.45) | ALDH1A1MAPTNPSR1HTTLMNA | |
| SCHEMBL2921634 | 0.82 | ALDH1A1 (0.47) | ALDH1A1MAPTNPSR1HTTLMNA | |
| SCHEMBL2921638 | 0.82 | ALDH1A1 (0.47) | ALDH1A1MAPTNPSR1HTTLMNA | |
| SCHEMBL1812380 | 0.79 | ALDH1A1 (0.41) | ALDH1A1MAPTNPSR1HTTLMNA | |
| SCHEMBL1809935 | 0.78 | FBP1 (0.50) | ALDH1A1MAPTLMNAHPGDRAB9A | |
| SCHEMBL3829294 | 0.77 | MAPT (0.44) | ALDH1A1MAPTNPSR1HTTLMNA | |
| SCHEMBL3829304 | 0.77 | MAPT (0.44) | ALDH1A1MAPTNPSR1HTTLMNA |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-4405353-A1 | NEW COMPOUNDS AND THEIR USE IN THE TREATMENT OF BACTERIAL INFECTION | F. Hoffmann-La Roche AG (CH) | 2024-07-31 | — | — | EP | disclosed |
| WO-2023041757-A1 | NEW COMPOUNDS AND THEIR USE IN THE TREATMENT OF BACTERIAL INFECTION | F. HOFFMANN-LA ROCHE AG (CH) | 2023-03-23 | — | — | WO | disclosed |
| EP-4126855-A1 | COMPOUNDS AND THEIR USE IN THE TREATMENT OF BACTERIAL INFECTION | F. Hoffmann-La Roche AG (CH) | 2023-02-08 | — | — | EP | disclosed |