Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RIPK1 | Q13546 | 2/20 | 0.50 |
| ▸ | NTRK1 | P04629 | 2/20 | 0.47 |
| ▸ | JAK2 | O60674 | 1/20 | 0.47 |
| ▸ | PDE5A | O76074 | 1/20 | 0.42 |
| ▸ | GPR119 | Q8TDV5 | 1/20 | 0.39 |
| ▸ | MAOB | P27338 | 2/20 | 0.39 |
| ▸ | NR1H2 | P55055 | 5/20 | 0.39 |
| ▸ | NR1H3 | Q13133 | 4/20 | 0.39 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.39 |
| ▸ | MAOA | P21397 | 1/20 | 0.39 |
| ▸ | TACR1 | P25103 | 3/20 | 0.38 |
| ▸ | RXRA | P19793 | 2/20 | 0.38 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.38 |
| ▸ | GHSR | Q92847 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL21723215 | 1.00 | RIPK1 (0.50) | RIPK1NTRK1JAK2PDE5AGPR119 | |
| SCHEMBL451781 | 1.00 | RIPK1 (0.50) | RIPK1NTRK1JAK2PDE5AGPR119 | |
| SCHEMBL430829 | 1.00 | RIPK1 (0.50) | RIPK1NTRK1JAK2PDE5AGPR119 | |
| SCHEMBL18588959 | 0.83 | NTRK1 (0.41) | NTRK1JAK2TACR1 | |
| SCHEMBL28537667 | 0.83 | NTRK1 (0.41) | NTRK1JAK2TACR1 | |
| SCHEMBL24526756 | 0.82 | TACR1 (0.35) | RIPK1NTRK1JAK2PDE5ANR1H2 | |
| SCHEMBL29759291 | 0.82 | TACR1 (0.35) | RIPK1NTRK1JAK2PDE5ANR1H2 | |
| SCHEMBL21313037 | 0.81 | NTRK1 (0.41) | NTRK1JAK2GPR119NR1H2NR1H3 | |
| SCHEMBL25315864 | 0.81 | RIPK1 (0.45) | RIPK1NTRK1JAK2PDE5AMAOB | |
| SCHEMBL24527025 | 0.80 | UCHL1 (0.38) | RIPK1NTRK1JAK2NR1H2NR1H3 |
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-4259620-A1 | ALDEHYDE DEHYDROGENASE INHIBITORS AND THEIR THERAPEUTIC USE | Cancer Research Technology Limited (GB) | 2023-10-18 | — | — | EP | disclosed |
| WO-2022123039-A1 | ALDEHYDE DEHYDROGENASE INHIBITORS AND THEIR THERAPEUTIC USE | CANCER RESEARCH TECHNOLOGY LIMITED (GB) | 2022-06-16 | — | — | WO | disclosed |