Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 2/20 | 0.60 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.60 |
| ▸ | S1PR5 | Q9H228 | 6/20 | 0.57 |
| ▸ | S1PR4 | O95977 | 4/20 | 0.57 |
| ▸ | S1PR1 | P21453 | 4/20 | 0.57 |
| ▸ | S1PR3 | Q99500 | 2/20 | 0.53 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.52 |
| ▸ | CACNA1G | O43497 | 2/20 | 0.51 |
| ▸ | LTA4H | P09960 | 2/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.50 |
| ▸ | DRD2 | P14416 | 1/20 | 0.49 |
| ▸ | HTR2A | P28223 | 1/20 | 0.49 |
| ▸ | HTR2C | P28335 | 1/20 | 0.49 |
| ▸ | HTR2B | P41595 | 1/20 | 0.49 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.49 |
| ▸ | MAPT | P10636 | 1/20 | 0.49 |
| ▸ | RAB9A | P51151 | 1/20 | 0.49 |
| ▸ | TEAD1 | P28347 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL15942972 | 0.92 | S1PR5 (0.63) | MEN1KMT2AS1PR5S1PR4S1PR1 | |
| SCHEMBL798026 | 0.88 | MEN1 (0.56) | MEN1KMT2AS1PR5S1PR4S1PR1 | |
| SCHEMBL15942971 | 0.86 | SIGMAR1 (0.57) | MEN1KMT2AS1PR5S1PR4S1PR1 | |
| SCHEMBL24529849 | 0.85 | SIGMAR1 (0.62) | S1PR5HRH3KDM4EALDH1A1SIGMAR1 | |
| SCHEMBL13242411 | 0.85 | S1PR5 (0.74) | S1PR5S1PR4S1PR1S1PR3 | |
| SCHEMBL7238102 | 0.84 | MEN1 (0.62) | MEN1KMT2AS1PR5CACNA1GSIGMAR1 | |
| SCHEMBL13236630 | 0.83 | S1PR5 (0.66) | S1PR5S1PR4S1PR1S1PR3HRH3 | |
| SCHEMBL797736 | 0.83 | S1PR1 (0.54) | MEN1KMT2AS1PR5S1PR4S1PR1 | |
| SCHEMBL2073212 | 0.81 | DRD2 (0.60) | MEN1KMT2AS1PR5HRH3KDM4E | |
| SCHEMBL12412709 | 0.81 | ALDH1A1 (0.59) | MEN1KMT2AHRH3KDM4EALDH1A1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8802663-B2 | Pyrazole oxadiazole derivatives as S1P1 agonists | MERCK SERONO SA (CH) | 2014-08-12 | — | — | US | disclosed |
| WO-2006002956-A1 | PIPERIDINE DERIVATIVES AND THEIR USE AS GLYCINE TRANSPORTER INHIBITORS | GLAXO GROUP LIMITED (GB) | 2006-01-12 | — | — | WO | disclosed |
| WO-2006002956-A1 | PIPERIDINE DERIVATIVES AND THEIR USE AS GLYCINE TRANSPORTER INHIBITORS | GLAXO GROUP LIMITED (GB) | 2006-01-12 | — | — | WO | disclosed |