Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S1PR1 | P21453 | 12/20 | 0.53 |
| ▸ | S1PR3 | Q99500 | 8/20 | 0.53 |
| ▸ | TNNC1 | P63316 | 6/20 | 0.53 |
| ▸ | S1PR4 | O95977 | 3/20 | 0.53 |
| ▸ | S1PR5 | Q9H228 | 2/20 | 0.53 |
| ▸ | SGPL1 | O95470 | 1/20 | 0.53 |
| ▸ | GPR183 | P32249 | 1/20 | 0.53 |
| ▸ | CERS2 | Q96G23 | 1/20 | 0.53 |
| ▸ | SPHK2 | Q9NRA0 | 2/20 | 0.46 |
| ▸ | SPHK1 | Q9NYA1 | 1/20 | 0.46 |
| ▸ | S1PR2 | O95136 | 2/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.42 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL1687940 | 1.00 | S1PR1 (0.53) | S1PR1S1PR3TNNC1S1PR4S1PR5 | |
| SCHEMBL1687946 | 1.00 | S1PR1 (0.53) | S1PR1S1PR3TNNC1S1PR4S1PR5 | |
| SCHEMBL904106 | 0.89 | S1PR1 (0.64) | S1PR1S1PR3TNNC1S1PR4S1PR5 | |
| SCHEMBL565320 | 0.84 | S1PR1 (0.60) | S1PR1S1PR3TNNC1S1PR4S1PR5 | |
| SCHEMBL10036674 | 0.81 | S1PR1 (0.82) | S1PR1S1PR3TNNC1S1PR4S1PR5 | |
| SCHEMBL1286791 | 0.81 | S1PR1 (0.82) | S1PR1S1PR3TNNC1S1PR4S1PR5 | |
| SCHEMBL16202260 | 0.80 | S1PR1 (0.55) | S1PR1S1PR3TNNC1S1PR4S1PR5 | |
| SCHEMBL16202259 | 0.80 | S1PR1 (0.67) | S1PR1S1PR3TNNC1S1PR4S1PR5 | |
| Hydrochloric Acid SCHEMBL7713960 | 0.80 | S1PR1 (0.83) | S1PR1S1PR3TNNC1S1PR4S1PR5 | |
| SCHEMBL13614227 | 0.77 | CYP1A2 (0.47) | S1PR1S1PR3TNNC1S1PR4S1PR5 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2011159870-A9 | METHODS AND COMPOUNDS FOR THE PREPARATION OF FLUORINE-LABELED DEOXY-FTY720 | BRACCO IMAGING S.P.A. (IT) | 2012-04-12 | — | — | WO | disclosed |
| WO-2011159870-A1 | METHODS AND COMPOUNDS FOR THE PREPARATION OF FLUORINE-LABELED DEOXY-FTY720 | BRACCO IMAGING S.P.A. (IT) | 2011-12-22 | — | — | WO | disclosed |