Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 6/20 | 0.55 |
| ▸ | S1PR1 | P21453 | 5/20 | 0.54 |
| ▸ | KIF11 | P52732 | 1/20 | 0.42 |
| ▸ | PTGS1 | P23219 | 4/20 | 0.38 |
| ▸ | AAK1 | Q2M2I8 | 5/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | THRB | P10828 | 1/20 | 0.36 |
| ▸ | MPL | P40238 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL4931412 | 0.95 | S1PR1 (0.58) | PTGS2S1PR1KIF11PTGS1AAK1 | |
| SCHEMBL4618798 | 0.90 | PTGS2 (0.67) | PTGS2S1PR1KIF11PTGS1LMNA | |
| SCHEMBL4618115 | 0.72 | S1PR1 (0.67) | S1PR1KIF11 | |
| SCHEMBL20615395 | 0.70 | S1PR1 (1.00) | S1PR1 | |
| SCHEMBL3275084 | 0.67 | S1PR1 (0.59) | S1PR1 | |
| SCHEMBL6733221 | 0.67 | PTGS2 (0.65) | PTGS2KIF11PTGS1 | |
| SCHEMBL22981523 | 0.67 | SGK1 (0.43) | PTGS2S1PR1KIF11MPL | |
| SCHEMBL6728375 | 0.66 | KIF11 (0.58) | PTGS2KIF11PTGS1 | |
| SCHEMBL6728905 | 0.66 | PTGS2 (0.66) | PTGS2KIF11PTGS1 | |
| SCHEMBL29793217 | 0.66 | KIF11 (0.60) | PTGS2KIF11PTGS1 |
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-1893591-A1 | POLYCYCLIC OXADIAZOLES OR I SOXAZOLES AND THEIR USE AS SlP RECEPTOR LIGANDS | Novartis AG (CH) | 2008-03-05 | — | — | EP | disclosed |
| WO-2006131336-A1 | POLYCYCLIC OXADIAZOLES OR I SOXAZOLES AND THEIR USE AS SlP RECEPTOR LIGANDS | NOVARTIS AG (CH) | 2006-12-14 | — | — | WO | disclosed |