Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S1PR1 | P21453 | 15/20 | 0.55 |
| ▸ | S1PR3 | Q99500 | 6/20 | 0.46 |
| ▸ | S1PR4 | O95977 | 1/20 | 0.43 |
| ▸ | S1PR5 | Q9H228 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 3/20 | 0.42 |
| ▸ | NPC1 | O15118 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | HPGD | P15428 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL1489274 | 0.92 | S1PR1 (0.56) | S1PR1S1PR3S1PR4S1PR5RAB9A | |
| SCHEMBL1488409 | 0.91 | S1PR1 (0.67) | S1PR1S1PR3S1PR4S1PR5KDM4E | |
| SCHEMBL1489212 | 0.89 | S1PR1 (0.51) | S1PR1S1PR3RAB9ANPC1MEN1 | |
| SCHEMBL1488671 | 0.88 | S1PR1 (0.43) | S1PR1S1PR3RAB9ANPC1KDM4E | |
| SCHEMBL1489283 | 0.83 | S1PR1 (0.68) | S1PR1S1PR3S1PR4S1PR5KDM4E | |
| SCHEMBL1488826 | 0.83 | S1PR1 (0.62) | S1PR1S1PR3S1PR4S1PR5KDM4E | |
| SCHEMBL1489113 | 0.82 | S1PR1 (0.55) | S1PR1S1PR3S1PR4S1PR5RAB9A | |
| SCHEMBL1490248 | 0.82 | S1PR1 (0.57) | S1PR1S1PR3S1PR4S1PR5RAB9A | |
| Hydrochloric Acid SCHEMBL1648509 | 0.81 | S1PR1 (0.57) | S1PR1S1PR3S1PR4S1PR5RAB9A | |
| SCHEMBL1489009 | 0.81 | S1PR1 (0.49) | S1PR1S1PR3S1PR4S1PR5ALDH1A1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2305660-A1 | New thiadiazole derivatives | Almirall, S.A. (ES) | 2011-04-06 | — | — | EP | disclosed |
| EP-2305660-A1 | New thiadiazole derivatives | Almirall, S.A. (ES) | 2011-04-06 | — | — | EP | disclosed |
| WO-2011035900-A1 | NEW THIADIAZOLE DERIVATIVES | ALMIRALL, S.A. (ES) | 2011-03-31 | — | — | WO | disclosed |
| WO-2011035900-A1 | NEW THIADIAZOLE DERIVATIVES | ALMIRALL, S.A. (ES) | 2011-03-31 | — | — | WO | disclosed |