Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.59 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.59 |
| ▸ | NPC1 | O15118 | 3/20 | 0.47 |
| ▸ | RAB9A | P51151 | 3/20 | 0.47 |
| ▸ | POLB | P06746 | 3/20 | 0.47 |
| ▸ | CA12 | O43570 | 3/20 | 0.44 |
| ▸ | CA1 | P00915 | 3/20 | 0.44 |
| ▸ | CA2 | P00918 | 3/20 | 0.44 |
| ▸ | CA7 | P43166 | 3/20 | 0.44 |
| ▸ | CA9 | Q16790 | 3/20 | 0.44 |
| ▸ | CA14 | Q9ULX7 | 3/20 | 0.44 |
| ▸ | PDCD1 | Q15116 | 1/20 | 0.44 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.44 |
| ▸ | GRM1 | Q13255 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | XPA | P23025 | 1/20 | 0.44 |
| ▸ | FAAH | O00519 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL14637938 | 0.87 | FAAH (0.55) | SMN1; SMN2ALDH1A1NPC1RAB9APOLB | |
| SCHEMBL22280424 | 0.81 | TP53 (0.47) | SMN1; SMN2ALDH1A1NPC1RAB9APOLB | |
| SCHEMBL14638292 | 0.80 | FAAH (0.53) | SMN1; SMN2ALDH1A1NPC1RAB9AFAAH | |
| SCHEMBL14636700 | 0.79 | CDK8 (0.50) | FAAHVCP | |
| SCHEMBL22280601 | 0.78 | SMN1; SMN2 (0.57) | SMN1; SMN2ALDH1A1NPC1RAB9APOLB | |
| SCHEMBL3067160 | 0.77 | SMN1; SMN2 (0.66) | SMN1; SMN2ALDH1A1NPC1RAB9APOLB | |
| SCHEMBL43683 | 0.73 | NPC1 (0.65) | SMN1; SMN2ALDH1A1NPC1RAB9ACA12 | |
| SCHEMBL30692281 | 0.73 | SMN1; SMN2 (0.56) | SMN1; SMN2ALDH1A1NPC1RAB9ACA12 | |
| SCHEMBL6057405 | 0.73 | SMN1; SMN2 (0.56) | SMN1; SMN2ALDH1A1NPC1RAB9ACA12 | |
| SCHEMBL20085556 | 0.72 | PDCD1 (0.59) | SMN1; SMN2ALDH1A1NPC1RAB9ACA12 |
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-2020153431-A1 | ESTER COMPOUND | 第一三共株式会社 | 2020-07-30 | — | — | WO | disclosed |
| WO-2020153431-A1 | ESTER COMPOUND | 第一三共株式会社 | 2020-07-30 | — | — | WO | disclosed |