Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S1PR1 | P21453 | 15/20 | 0.65 |
| ▸ | S1PR3 | Q99500 | 6/20 | 0.52 |
| ▸ | S1PR5 | Q9H228 | 2/20 | 0.51 |
| ▸ | S1PR4 | O95977 | 1/20 | 0.51 |
| ▸ | ACHE | P22303 | 1/20 | 0.45 |
| ▸ | CPB1 | P15086 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.43 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL1965594 | 0.94 | S1PR1 (0.57) | S1PR1S1PR3S1PR5S1PR4ACHE | |
| SCHEMBL1966443 | 0.94 | S1PR1 (0.67) | S1PR1S1PR3S1PR5S1PR4ACHE | |
| SCHEMBL2295298 | 0.90 | S1PR1 (0.75) | S1PR1S1PR3S1PR5S1PR4 | |
| SCHEMBL1964739 | 0.81 | S1PR1 (0.83) | S1PR1S1PR3S1PR5S1PR4KDM4E | |
| SCHEMBL1965472 | 0.80 | S1PR1 (0.81) | S1PR1S1PR3S1PR5S1PR4 | |
| SCHEMBL1964218 | 0.79 | S1PR1 (0.83) | S1PR1S1PR3S1PR5S1PR4 | |
| SCHEMBL1965815 | 0.79 | S1PR1 (1.00) | S1PR1S1PR3S1PR5S1PR4 | |
| SCHEMBL1964964 | 0.78 | S1PR1 (1.00) | S1PR1S1PR3S1PR5S1PR4 | |
| SCHEMBL1964578 | 0.78 | S1PR1 (0.78) | S1PR1S1PR3S1PR5S1PR4CPB1 | |
| SCHEMBL2301982 | 0.76 | S1PR1 (0.52) | S1PR1CPB1KDM4ENPC1ALDH1A1 |
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-2334670-A1 | NEW 2-AMIDOTHIADIAZOLE DERIVATIVES | Almirall S.A. (ES) | 2011-06-22 | — | — | EP | claimed |
| WO-2010043377-A1 | NEW 2-AMIDOTHIADIAZOLE DERIVATIVES | ALMIRALL, S.A. (ES) | 2010-04-22 | — | — | WO | claimed |
| EP-2334670-A1 | NEW 2-AMIDOTHIADIAZOLE DERIVATIVES | Almirall S.A. (ES) | 2011-06-22 | — | — | EP | disclosed |
| WO-2010043377-A1 | NEW 2-AMIDOTHIADIAZOLE DERIVATIVES | ALMIRALL, S.A. (ES) | 2010-04-22 | — | — | WO | disclosed |