Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S1PR1 | P21453 | 8/20 | 0.58 |
| ▸ | ACHE | P22303 | 3/20 | 0.45 |
| ▸ | FFAR1 | O14842 | 2/20 | 0.43 |
| ▸ | MAOB | P27338 | 3/20 | 0.41 |
| ▸ | S1PR3 | Q99500 | 2/20 | 0.41 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.41 |
| ▸ | ALOX5 | P09917 | 2/20 | 0.38 |
| ▸ | PTGES | O14684 | 1/20 | 0.38 |
| ▸ | MAOA | P21397 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL4566137 | 0.83 | S1PR1 (0.58) | S1PR1FFAR1MAOBS1PR3 | |
| SCHEMBL1601906 | 0.74 | S1PR1 (0.82) | S1PR1FFAR1S1PR3 | |
| SCHEMBL1600903 | 0.73 | S1PR1 (1.00) | S1PR1S1PR3 | |
| SCHEMBL1602093 | 0.71 | S1PR1 (0.57) | S1PR1ACHEFFAR1MAOBCYP2C8 | |
| SCHEMBL3812511 | 0.69 | S1PR1 (0.69) | S1PR1ACHEFFAR1S1PR3CYP2C8 | |
| Alcohol SCHEMBL27541427 | 0.68 | TSHR (0.53) | — | |
| SCHEMBL12706849 | 0.68 | S1PR1 (0.69) | S1PR1ACHEMAOBS1PR3CYP2C8 | |
| SCHEMBL28202643 | 0.68 | FABP7 (0.50) | — | |
| SCHEMBL606466 | 0.67 | TSHR (0.55) | — | |
| SCHEMBL7601727 | 0.66 | RARB (0.61) | S1PR1FFAR1 |
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-1965807-A2 | S1P RECEPTOR MODULATING COMPOUNDS AND USE THEREOF | Epix Delaware, Inc. (US) | 2008-09-10 | — | — | EP | claimed |
| WO-2007061458-A2 | S1P RECEPTOR MODULATING COMPOUNDS AND USE THEREOF | EPIX DELAWARE, INC. (US) | 2007-05-31 | — | — | WO | claimed |
| EP-1965807-A2 | S1P RECEPTOR MODULATING COMPOUNDS AND USE THEREOF | Epix Delaware, Inc. (US) | 2008-09-10 | — | — | EP | disclosed |
| WO-2007061458-A2 | S1P RECEPTOR MODULATING COMPOUNDS AND USE THEREOF | EPIX DELAWARE, INC. (US) | 2007-05-31 | — | — | WO | disclosed |