Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.48 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.48 |
| ▸ | GPR88 | Q9GZN0 | 1/20 | 0.42 |
| ▸ | S1PR2 | O95136 | 3/20 | 0.40 |
| ▸ | S1PR4 | O95977 | 3/20 | 0.40 |
| ▸ | S1PR1 | P21453 | 3/20 | 0.40 |
| ▸ | S1PR3 | Q99500 | 3/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | MITF | O75030 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | ANPEP | P15144 | 1/20 | 0.37 |
| ▸ | ERAP2 | Q6P179 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | ACACB | O00763 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL3042232 | 0.79 | S1PR2 (0.57) | ALDH1A1CYP1A2CYP2D6S1PR2S1PR4 | |
| SCHEMBL3042226 | 0.79 | S1PR2 (0.57) | ALDH1A1CYP1A2CYP2D6S1PR2S1PR4 | |
| SCHEMBL13220995 | 0.79 | S1PR2 (0.57) | ALDH1A1CYP1A2CYP2D6S1PR2S1PR4 | |
| SCHEMBL28181025 | 0.77 | GPR88 (0.44) | ALDH1A1GPR88ACACB | |
| SCHEMBL725878 | 0.76 | ALDH1A1 (0.72) | ALDH1A1CYP1A2CYP2D6S1PR2S1PR4 | |
| SCHEMBL15819968 | 0.76 | ANPEP (0.59) | ALDH1A1CYP1A2CYP2D6MEN1KMT2A | |
| SCHEMBL6492794 | 0.76 | ANPEP (0.59) | ALDH1A1CYP1A2CYP2D6MEN1KMT2A | |
| SCHEMBL6499108 | 0.76 | ANPEP (0.59) | ALDH1A1CYP1A2CYP2D6MEN1KMT2A | |
| SCHEMBL8082104 | 0.75 | ALDH1A1 (0.54) | ALDH1A1CYP1A2CYP2D6GPR88SMN1; SMN2 | |
| SCHEMBL12808649 | 0.74 | ALDH1A1 (0.42) | ALDH1A1CYP1A2GPR88S1PR1SMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2395835-A1 | AGONISTS AND ANTAGONISTS OF THE SIP5 RECEPTOR, AND METHODS OF USES THEREOF | Abbott Laboratories (US) | 2011-12-21 | — | — | EP | claimed |
| WO-2010093704-A1 | AGONISTS AND ANTAGONISTS OF THE S1P5 RECEPTOR, AND METHODS OF USES THEREOF | ABBOTT LABORATORIES (US) | 2010-08-19 | — | — | WO | claimed |