Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A2 | P23975 | 3/20 | 0.42 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.42 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.37 |
| ▸ | PPARG | P37231 | 2/20 | 0.37 |
| ▸ | P2RX7 | Q99572 | 4/20 | 0.37 |
| ▸ | NTRK1 | P04629 | 3/20 | 0.37 |
| ▸ | IDO1 | P14902 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.34 |
| ▸ | PDE2A | O00408 | 1/20 | 0.33 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL18893127 | 0.80 | EPHX2 (0.44) | EPHX2PPARGIDO1 | |
| SCHEMBL22957708 | 0.79 | NTRK1 (0.42) | SLC6A4NTRK1ALDH1A1 | |
| SCHEMBL22957885 | 0.78 | SLC6A4 (0.39) | SLC6A2SLC6A4PPARGALDH1A1SLC6A3 | |
| SCHEMBL13452580 | 0.77 | SLC6A4 (0.47) | SLC6A2SLC6A4P2RX7NTRK1IDO1 | |
| SCHEMBL8415469 | 0.75 | IDO1 (0.46) | SLC6A2SLC6A4EPHX2PPARGP2RX7 | |
| SCHEMBL17069238 | 0.74 | SLC6A2 (0.51) | SLC6A2SLC6A4EPHX2PPARGP2RX7 | |
| SCHEMBL13064739 | 0.72 | IDO1 (0.43) | SLC6A2SLC6A4P2RX7IDO1 | |
| SCHEMBL75416 | 0.71 | IDO1 (0.46) | SLC6A2SLC6A4P2RX7NTRK1IDO1 | |
| SCHEMBL5724257 | 0.71 | P2RX7 (0.50) | EPHX2PPARGP2RX7NTRK1 | |
| SCHEMBL19405219 | 0.69 | SLC6A2 (0.41) | SLC6A2SLC6A4EPHX2PPARGIDO1 |
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-2023144160-A1 | NEW HETEROCYCLIC COMPOUNDS | F. HOFFMANN-LA ROCHE AG (CH) | 2023-08-03 | — | — | WO | disclosed |