Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S1PR1 | P21453 | 15/20 | 0.62 |
| ▸ | S1PR3 | Q99500 | 3/20 | 0.41 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.37 |
| ▸ | MAOA | P21397 | 1/20 | 0.37 |
| ▸ | BLVRB | P30043 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | BDKRB1 | P46663 | 1/20 | 0.36 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.36 |
| ▸ | HDAC5 | Q9UQL6 | 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 | |
|---|---|---|---|---|
| SCHEMBL558111 | 0.94 | S1PR1 (0.68) | S1PR1S1PR3HDAC6HDAC1HDAC5 | |
| SCHEMBL18901458 | 0.92 | S1PR1 (0.56) | S1PR1S1PR3 | |
| SCHEMBL408681 | 0.87 | S1PR1 (0.58) | S1PR1S1PR3HDAC6HDAC1HDAC5 | |
| SCHEMBL557380 | 0.85 | S1PR1 (0.76) | S1PR1S1PR3 | |
| SCHEMBL557834 | 0.84 | S1PR1 (0.73) | S1PR1S1PR3 | |
| SCHEMBL536207 | 0.84 | S1PR1 (0.86) | S1PR1S1PR3 | |
| SCHEMBL409331 | 0.83 | S1PR1 (0.57) | S1PR1S1PR3HDAC6NPC1RAB9A | |
| SCHEMBL558362 | 0.83 | S1PR1 (0.65) | S1PR1S1PR3HDAC6HDAC1HDAC5 | |
| SCHEMBL10170274 | 0.82 | S1PR1 (0.52) | S1PR1S1PR3HDAC6HDAC1HDAC5 | |
| SCHEMBL18901482 | 0.82 | S1PR1 (0.71) | S1PR1S1PR3 |
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-2414342-B1 | OXADIAZOLE DERIVATIVES | MERCK SERONO SA (CH) | 2017-05-31 | — | — | EP | disclosed |