Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 7/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.53 |
| ▸ | NPC1 | O15118 | 6/20 | 0.53 |
| ▸ | MAPT | P10636 | 5/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.53 |
| ▸ | LMNA | P02545 | 3/20 | 0.53 |
| ▸ | GAA | P10253 | 2/20 | 0.53 |
| ▸ | GLA | P06280 | 1/20 | 0.53 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.52 |
| ▸ | HPGD | P15428 | 2/20 | 0.52 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.52 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.52 |
| ▸ | FBP1 | P09467 | 1/20 | 0.52 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.52 |
| ▸ | DRD2 | P14416 | 1/20 | 0.52 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.52 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.52 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.52 |
| ▸ | DRD1 | P21728 | 1/20 | 0.52 |
| ▸ | MC5R | P33032 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL29812612 | 0.98 | RAB9A (0.55) | RAB9AALDH1A1NPC1MAPTKDM4E | |
| SCHEMBL54329 | 0.98 | RAB9A (0.55) | RAB9AALDH1A1NPC1MAPTKDM4E | |
| Hydrochloric Acid SCHEMBL28286069 | 0.95 | RAB9A (0.53) | RAB9AALDH1A1NPC1MAPTKDM4E | |
| Water SCHEMBL8700534 | 0.95 | ALDH1A1 (0.53) | RAB9AALDH1A1NPC1MAPTKDM4E | |
| SCHEMBL11740091 | 0.95 | RAB9A (0.53) | RAB9AALDH1A1NPC1MAPTKDM4E | |
| Phosphoric Acid SCHEMBL5146526 | 0.88 | DDAH1 (0.59) | RAB9AALDH1A1NPC1MAPTKDM4E | |
| Aminothiazole SCHEMBL9081032 | 0.83 | ALDH1A1 (0.47) | RAB9AALDH1A1NPC1MAPTKDM4E | |
| SCHEMBL11162902 | 0.82 | RAB9A (0.47) | RAB9AALDH1A1NPC1MAPTKDM4E | |
| Methane SCHEMBL28056221 | 0.76 | RAB9A (0.64) | RAB9AALDH1A1NPC1MAPTKDM4E | |
| SCHEMBL8032061 | 0.75 | RAB9A (0.56) | RAB9AALDH1A1NPC1MAPTKDM4E |
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-117362162-A | Preparation method of carbonyl compound | 中国科学院大连化学物理研究所 | 2024-01-09 | — | — | CN | disclosed |