Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S1PR5 | Q9H228 | 8/20 | 0.52 |
| ▸ | S1PR1 | P21453 | 7/20 | 0.52 |
| ▸ | GRK5 | P34947 | 1/20 | 0.52 |
| ▸ | CDK8 | P49336 | 1/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.52 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.52 |
| ▸ | MEN1 | O00255 | 1/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.51 |
| ▸ | PDGFRA | P16234 | 2/20 | 0.50 |
| ▸ | FAAH | O00519 | 1/20 | 0.47 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.47 |
| ▸ | PRKX | P51817 | 1/20 | 0.46 |
| ▸ | IKBKE | Q14164 | 1/20 | 0.46 |
| ▸ | MAOA | P21397 | 3/20 | 0.46 |
| ▸ | MAOB | P27338 | 3/20 | 0.46 |
| ▸ | KDM2B | Q8NHM5 | 1/20 | 0.46 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.46 |
| ▸ | GRM3 | Q14832 | 1/20 | 0.46 |
| ▸ | PIM1 | P11309 | 1/20 | 0.45 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL14556031 | 1.00 | S1PR5 (0.52) | S1PR5S1PR1GRK5CDK8ALDH1A1 | |
| SCHEMBL15967678 | 0.88 | S1PR5 (0.52) | S1PR5S1PR1GRK5CDK8ALDH1A1 | |
| SCHEMBL14486732 | 0.88 | S1PR5 (0.52) | S1PR5S1PR1GRK5CDK8ALDH1A1 | |
| SCHEMBL14555893 | 0.86 | ALDH1A1 (0.56) | S1PR5S1PR1GRK5CDK8ALDH1A1 | |
| SCHEMBL14486508 | 0.86 | ALDH1A1 (0.56) | S1PR5S1PR1GRK5CDK8ALDH1A1 | |
| SCHEMBL23243788 | 0.83 | MAOA (0.51) | S1PR5S1PR1MAOAMAOB | |
| SCHEMBL20745461 | 0.83 | MAOA (0.51) | S1PR5S1PR1MAOAMAOB | |
| SCHEMBL20745387 | 0.83 | MAOA (0.51) | S1PR5S1PR1MAOAMAOB | |
| SCHEMBL14555989 | 0.83 | MAOA (0.51) | S1PR5S1PR1MAOAMAOB | |
| SCHEMBL16764924 | 0.83 | MAOA (0.51) | S1PR5S1PR1MAOAMAOB |
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-2729445-A1 | CYCLIC AMINE DERIVATIVES AS EP4 RECEPTOR ANTAGONISTS | Rottapharm S.p.A. (IT) | 2014-05-14 | — | — | EP | disclosed |
| EP-2729141-A1 | CYCLIC AMINE DERIVATIVES AS EP4 RECEPTOR AGONISTS | Rottapharm S.p.A. (IT) | 2014-05-14 | — | — | EP | disclosed |
| WO-2013004291-A1 | CYCLIC AMINE DERIVATIVES AS EP4 RECEPTOR AGONISTS | ROTTAPHARM S.P.A. (IT) | 2013-01-10 | — | — | WO | disclosed |
| WO-2013004290-A1 | CYCLIC AMINE DERIVATIVES AS EP4 RECEPTOR ANTAGONISTS | ROTTAPHARM S.P.A. (IT) | 2013-01-10 | — | — | WO | disclosed |