Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S1PR1 | P21453 | 19/20 | 0.44 |
| ▸ | S1PR3 | Q99500 | 4/20 | 0.39 |
| ▸ | S1PR4 | O95977 | 1/20 | 0.37 |
| ▸ | S1PR5 | Q9H228 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL1981614 | 0.89 | S1PR1 (0.45) | S1PR1S1PR3S1PR4S1PR5KDM4E | |
| SCHEMBL1979486 | 0.87 | S1PR1 (0.43) | S1PR1S1PR3KDM4EMEN1CYP1A2 | |
| SCHEMBL12599365 | 0.84 | NR1H2 (0.36) | S1PR1MEN1KMT2A | |
| SCHEMBL1981126 | 0.78 | S1PR1 (0.50) | S1PR1S1PR3S1PR4S1PR5KDM4E | |
| SCHEMBL2231440 | 0.76 | S1PR1 (0.46) | S1PR1S1PR3S1PR4S1PR5KDM4E | |
| SCHEMBL1980001 | 0.76 | S1PR1 (0.44) | S1PR1S1PR3S1PR4S1PR5KDM4E | |
| SCHEMBL12522034 | 0.76 | S1PR1 (0.53) | S1PR1S1PR3S1PR4S1PR5 | |
| SCHEMBL1979890 | 0.76 | S1PR1 (0.44) | S1PR1S1PR3S1PR4S1PR5KDM4E | |
| SCHEMBL2230853 | 0.75 | S1PR1 (0.49) | S1PR1S1PR3S1PR4S1PR5KDM4E | |
| SCHEMBL1979878 | 0.73 | S1PR1 (0.49) | S1PR1S1PR3S1PR4S1PR5KDM4E |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2343287-A1 | New 2-aminothiadiazole derivatives | Almirall, S.A. (ES) | 2011-07-13 | — | — | EP | claimed |
| WO-2011069647-A1 | NEW 2-AMINOTHIADIAZOLE DERIVATIVES | ALMIRALL, S.A. (ES) | 2011-06-16 | — | — | WO | claimed |
| EP-2343287-A1 | New 2-aminothiadiazole derivatives | Almirall, S.A. (ES) | 2011-07-13 | — | — | EP | disclosed |
| EP-2343287-A1 | New 2-aminothiadiazole derivatives | Almirall, S.A. (ES) | 2011-07-13 | — | — | EP | disclosed |
| WO-2011069647-A1 | NEW 2-AMINOTHIADIAZOLE DERIVATIVES | ALMIRALL, S.A. (ES) | 2011-06-16 | — | — | WO | disclosed |