Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.56 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.56 |
| ▸ | HPGD | P15428 | 2/20 | 0.56 |
| ▸ | NPC1 | O15118 | 3/20 | 0.46 |
| ▸ | RAB9A | P51151 | 3/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 2/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | SQLE | Q14534 | 2/20 | 0.39 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL28575333 | 1.00 | ALDH1A1 (0.56) | ALDH1A1SMN1; SMN2HPGDNPC1RAB9A | |
| SCHEMBL7212010 | 0.77 | ALDH1A1 (0.60) | ALDH1A1SMN1; SMN2HPGDNPC1RAB9A | |
| SCHEMBL12077803 | 0.76 | ALDH1A1 (0.68) | ALDH1A1SMN1; SMN2HPGDNPC1RAB9A | |
| SCHEMBL7885963 | 0.71 | ALDH1A1 (0.61) | ALDH1A1SMN1; SMN2HPGDNPC1RAB9A | |
| SCHEMBL27961616 | 0.70 | ALDH1A1 (0.59) | ALDH1A1SMN1; SMN2HPGDNPC1RAB9A | |
| SCHEMBL7127961 | 0.70 | SMN1; SMN2 (0.59) | ALDH1A1SMN1; SMN2HPGDNPC1RAB9A | |
| SCHEMBL20960732 | 0.68 | ALDH1A1 (0.53) | ALDH1A1SMN1; SMN2HPGDNPC1RAB9A | |
| SCHEMBL4430978 | 0.68 | ALDH1A1 (0.56) | ALDH1A1SMN1; SMN2HPGDNPC1RAB9A | |
| SCHEMBL29268398 | 0.67 | ALDH1A1 (0.56) | ALDH1A1SMN1; SMN2HPGDNPC1RAB9A | |
| SCHEMBL5282738 | 0.67 | ALDH1A1 (0.61) | ALDH1A1SMN1; SMN2HPGDNPC1RAB9A |
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-110204465-B | Method for synthesizing homoallylamine compound by photocatalysis | 西北师范大学 | 2021-05-11 | — | — | CN | disclosed |