Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.68 |
| ▸ | GAA | P10253 | 2/20 | 0.66 |
| ▸ | AKR1C3 | P42330 | 4/20 | 0.63 |
| ▸ | HPGD | P15428 | 4/20 | 0.59 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.59 |
| ▸ | NPC1 | O15118 | 1/20 | 0.56 |
| ▸ | RAB9A | P51151 | 1/20 | 0.56 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.53 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.53 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.53 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.53 |
| ▸ | RECQL | P46063 | 1/20 | 0.53 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.51 |
| ▸ | TSHR | P16473 | 1/20 | 0.50 |
| ▸ | SGMS1 | Q86VZ5 | 1/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.48 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.48 |
| ▸ | POLB | P06746 | 1/20 | 0.48 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.48 |
| ▸ | MGAT3 | Q09327 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL30709142 | 1.00 | ALDH1A1 (0.68) | ALDH1A1GAAAKR1C3HPGDHSD17B10 | |
| SCHEMBL26603286 | 0.91 | ALDH1A1 (0.72) | ALDH1A1GAAAKR1C3HPGDHSD17B10 | |
| SCHEMBL26603248 | 0.91 | GAA (0.63) | ALDH1A1GAAAKR1C3HPGDHSD17B10 | |
| SCHEMBL30709104 | 0.91 | GAA (0.63) | ALDH1A1GAAAKR1C3HPGDHSD17B10 | |
| SCHEMBL26603266 | 0.90 | PARG (0.57) | ALDH1A1GAAAKR1C3NPC1RAB9A | |
| SCHEMBL30709059 | 0.90 | PARG (0.57) | ALDH1A1GAAAKR1C3NPC1RAB9A | |
| SCHEMBL26603347 | 0.89 | ALDH1A1 (0.81) | ALDH1A1GAAAKR1C3HPGDHSD17B10 | |
| SCHEMBL30626165 | 0.89 | GAA (0.61) | ALDH1A1GAAAKR1C3HPGDHSD17B10 | |
| SCHEMBL26603291 | 0.89 | GAA (0.61) | ALDH1A1GAAAKR1C3HPGDHSD17B10 | |
| SCHEMBL26603495 | 0.88 | GAA (0.70) | ALDH1A1GAAAKR1C3HPGDHSD17B10 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023202582-A1 | GPCR REGULATOR AND USE THEREOF | 北京昌平实验室 | 2023-10-26 | — | — | WO | disclosed |