Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SPHK1 | Q9NYA1 | 14/20 | 0.49 |
| ▸ | SPHK2 | Q9NRA0 | 8/20 | 0.49 |
| ▸ | S1PR4 | O95977 | 1/20 | 0.45 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.45 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.45 |
| ▸ | S1PR5 | Q9H228 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL23236412 | 0.87 | SPHK1 (0.47) | SPHK1SPHK2S1PR4S1PR1S1PR3 | |
| SCHEMBL23236376 | 0.83 | SPHK1 (0.55) | SPHK1SPHK2S1PR4S1PR1S1PR3 | |
| SCHEMBL23236372 | 0.83 | SPHK1 (0.55) | SPHK1SPHK2S1PR4S1PR1S1PR3 | |
| SCHEMBL23236395 | 0.80 | SPHK1 (0.55) | SPHK1SPHK2 | |
| SCHEMBL23236399 | 0.80 | SPHK1 (0.55) | SPHK1SPHK2 | |
| SCHEMBL20595779 | 0.79 | CYP2D6 (0.61) | — | |
| SCHEMBL23236390 | 0.74 | SPHK1 (0.64) | SPHK1SPHK2S1PR4S1PR1S1PR3 | |
| SCHEMBL23236392 | 0.74 | SPHK1 (0.64) | SPHK1SPHK2S1PR4S1PR1S1PR3 | |
| SCHEMBL15935933 | 0.72 | SPHK1 (0.67) | SPHK1SPHK2 | |
| SCHEMBL15935942 | 0.72 | SPHK1 (0.67) | SPHK1SPHK2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3806849-A1 | SYNTHETIC CYTOTOXIC MOLECULES, DRUGS, METHODS OF THEIR SYNTHESIS AND METHODS OF TREATMENT | The Regents of the University of California (US) | 2021-04-21 | — | — | EP | disclosed |