Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S1PR1 | P21453 | 10/20 | 0.52 |
| ▸ | S1PR3 | Q99500 | 7/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.49 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.49 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.49 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.49 |
| ▸ | TNNC1 | P63316 | 5/20 | 0.48 |
| ▸ | S1PR4 | O95977 | 4/20 | 0.48 |
| ▸ | S1PR5 | Q9H228 | 4/20 | 0.48 |
| ▸ | SGPL1 | O95470 | 1/20 | 0.48 |
| ▸ | GPR183 | P32249 | 1/20 | 0.48 |
| ▸ | CERS2 | Q96G23 | 1/20 | 0.48 |
| ▸ | S1PR2 | O95136 | 1/20 | 0.44 |
| ▸ | HTR2A | P28223 | 2/20 | 0.43 |
| ▸ | DRD2 | P14416 | 1/20 | 0.43 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.43 |
| ▸ | HTR2C | P28335 | 1/20 | 0.43 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.43 |
| ▸ | SPHK2 | Q9NRA0 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL14195974 | 1.00 | S1PR1 (0.52) | S1PR1S1PR3CYP3A4CYP2C8CYP2D6 | |
| SCHEMBL14196344 | 1.00 | S1PR1 (0.52) | S1PR1S1PR3CYP3A4CYP2C8CYP2D6 | |
| SCHEMBL14206161 | 0.98 | S1PR1 (0.52) | S1PR1S1PR3CYP3A4CYP2C8CYP2D6 | |
| SCHEMBL14206162 | 0.98 | S1PR1 (0.52) | S1PR1S1PR3CYP3A4CYP2C8CYP2D6 | |
| SCHEMBL14206164 | 0.98 | S1PR1 (0.52) | S1PR1S1PR3CYP3A4CYP2C8CYP2D6 | |
| SCHEMBL14207980 | 0.93 | S1PR1 (0.54) | S1PR1S1PR3CYP3A4CYP2C8CYP2D6 | |
| SCHEMBL14207982 | 0.93 | S1PR1 (0.54) | S1PR1S1PR3CYP3A4CYP2C8CYP2D6 | |
| SCHEMBL14207584 | 0.93 | S1PR1 (0.54) | S1PR1S1PR3CYP3A4CYP2C8CYP2D6 | |
| SCHEMBL13243639 | 0.90 | S1PR1 (0.46) | S1PR1S1PR3CYP3A4CYP2C8CYP2D6 | |
| SCHEMBL14196647 | 0.90 | S1PR1 (0.46) | S1PR1S1PR3CYP3A4CYP2C8CYP2D6 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2008064315-A1 | TETRALIN ANALOGS HAVING SPHINGOSINE 1-PHOSPHATE AGONIST ACTIVITY | UNIVERSITY OF VIRGINIA PATENT FOUNDATION (US) | 2008-05-29 | — | — | WO | disclosed |