Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.37 |
| ▸ | CA1 | P00915 | 3/20 | 0.36 |
| ▸ | CA9 | Q16790 | 3/20 | 0.36 |
| ▸ | MMP3 | P08254 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 4/20 | 0.32 |
| ▸ | RAB9A | P51151 | 4/20 | 0.32 |
| ▸ | LMNA | P02545 | 3/20 | 0.32 |
| ▸ | PRNP | P04156 | 2/20 | 0.32 |
| ▸ | HTT | P42858 | 2/20 | 0.32 |
| ▸ | THRB | P10828 | 1/20 | 0.32 |
| ▸ | NR0B1 | P51843 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.32 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | GMNN | O75496 | 1/20 | 0.30 |
| ▸ | MTOR | P42345 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL250404 | 1.00 | SMN1; SMN2 (0.37) | SMN1; SMN2CA1CA9MMP3ALDH1A1 | |
| SCHEMBL30269 | 1.00 | SMN1; SMN2 (0.37) | SMN1; SMN2CA1CA9MMP3ALDH1A1 | |
| SCHEMBL30272 | 1.00 | SMN1; SMN2 (0.37) | SMN1; SMN2CA1CA9MMP3ALDH1A1 | |
| Ethylene SCHEMBL11669780 | 0.96 | SMN1; SMN2 (0.34) | SMN1; SMN2CA1CA9MMP3ALDH1A1 | |
| Ethylene SCHEMBL6720301 | 0.96 | SMN1; SMN2 (0.34) | SMN1; SMN2CA1CA9MMP3ALDH1A1 | |
| Ethylene Glycol SCHEMBL28457562 | 0.90 | MMP3 (0.35) | SMN1; SMN2CA1CA9MMP3NPC1 | |
| Ethylene Glycol SCHEMBL28461659 | 0.90 | MMP3 (0.35) | SMN1; SMN2CA1CA9MMP3NPC1 | |
| Ethylene Glycol SCHEMBL29155627 | 0.90 | MMP3 (0.35) | SMN1; SMN2CA1CA9MMP3NPC1 | |
| Ethylene Glycol SCHEMBL28898450 | 0.90 | MMP3 (0.35) | SMN1; SMN2CA1CA9MMP3NPC1 | |
| SCHEMBL10981369 | 0.89 | CA1 (0.33) | SMN1; SMN2CA1CA9NPC1RAB9A |
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 |
|---|---|---|---|---|---|---|---|
| CN-113354904-B | Polymer elastomer based on crystalline phase transition and shape memory behavior regulation and control method thereof | 浙江大学衢州研究院 | 2022-11-08 | — | — | CN | claimed |