Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CNR1 | P21554 | 1/20 | 0.62 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.51 |
| ▸ | NPC1 | O15118 | 1/20 | 0.50 |
| ▸ | MAPT | P10636 | 1/20 | 0.50 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.50 |
| ▸ | HTT | P42858 | 1/20 | 0.50 |
| ▸ | RAB9A | P51151 | 1/20 | 0.50 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.50 |
| ▸ | NSD2 | O96028 | 1/20 | 0.49 |
| ▸ | DYRK1A | Q13627 | 3/20 | 0.48 |
| ▸ | IDO1 | P14902 | 1/20 | 0.48 |
| ▸ | TDO2 | P48775 | 1/20 | 0.48 |
| ▸ | DNMT3A | Q9Y6K1 | 1/20 | 0.47 |
| ▸ | USP30 | Q70CQ3 | 1/20 | 0.46 |
| ▸ | GPR119 | Q8TDV5 | 3/20 | 0.45 |
| ▸ | GSK3B | P49841 | 1/20 | 0.45 |
| ▸ | FPR3 | P25089 | 1/20 | 0.44 |
| ▸ | FPR2 | P25090 | 1/20 | 0.44 |
| ▸ | DDB1 | Q16531 | 1/20 | 0.44 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL26967728 | 1.00 | CNR1 (0.62) | CNR1ALDH1A1NPC1MAPTMAPK1 | |
| SCHEMBL29908994 | 1.00 | CNR1 (0.62) | CNR1ALDH1A1NPC1MAPTMAPK1 | |
| SCHEMBL28581769 | 0.84 | L3MBTL1 (0.52) | CNR1ALDH1A1NPC1RAB9AL3MBTL1 | |
| SCHEMBL26967715 | 0.84 | DYRK1A (0.52) | CNR1DYRK1AIDO1GSK3B | |
| SCHEMBL31632893 | 0.82 | ALDH1A1 (0.59) | CNR1ALDH1A1NPC1MAPTMAPK1 | |
| SCHEMBL3523230 | 0.80 | KIT (0.47) | CNR1ALDH1A1MAPTDYRK1AIDO1 | |
| SCHEMBL3299990 | 0.80 | DDB1 (0.54) | CNR1ALDH1A1NPC1MAPTMAPK1 | |
| SCHEMBL2144340 | 0.79 | IDO1 (0.45) | CNR1HTTIDO1TDO2USP30 | |
| SCHEMBL31029626 | 0.79 | IRAK4 (0.65) | ALDH1A1NSD2GPR119IRAK4BTK | |
| SCHEMBL30902132 | 0.79 | IRAK4 (0.65) | ALDH1A1NSD2GPR119IRAK4BTK |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-4294811-A2 | SMALL MOLECULES THAT BIND TO TDP-43 FOR THE TREATMENT OF ALS AND RELATED DISORDERS | Biohaven Therapeutics Ltd. (US) | 2023-12-27 | — | — | EP | disclosed |
| WO-2022178338-A2 | SMALL MOLECULES THAT BIND TO TDP-43 FOR THE TREATMENT OF ALS AND RELATED DISORDERS | BIOHAVEN THERAPEUTICS LTD. (US) | 2022-08-25 | — | — | WO | disclosed |