Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A2 | P23975 | 1/20 | 0.46 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.46 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.46 |
| ▸ | HRH1 | P35367 | 3/20 | 0.46 |
| ▸ | PGR | P06401 | 2/20 | 0.46 |
| ▸ | IKBKB | O14920 | 1/20 | 0.45 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.43 |
| ▸ | ROCK1 | Q13464 | 2/20 | 0.43 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.43 |
| ▸ | PRKACA | P17612 | 1/20 | 0.43 |
| ▸ | PRKCD | Q05655 | 1/20 | 0.43 |
| ▸ | PRKG1 | Q13976 | 1/20 | 0.43 |
| ▸ | PKN1 | Q16512 | 1/20 | 0.43 |
| ▸ | PKN2 | Q16513 | 1/20 | 0.43 |
| ▸ | AAK1 | Q2M2I8 | 1/20 | 0.43 |
| ▸ | CDC42BPA | Q5VT25 | 1/20 | 0.43 |
| ▸ | Q6ZSR9 | Q6ZSR9 | 1/20 | 0.43 |
| ▸ | BMP2K | Q9NSY1 | 1/20 | 0.43 |
| ▸ | CDC42BPB | Q9Y5S2 | 1/20 | 0.43 |
| ▸ | ALK | Q9UM73 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL4969971 | 0.88 | PGR (0.58) | SLC6A2SLC6A4SLC6A3HRH1PGR | |
| Hydrochloric Acid SCHEMBL4228810 | 0.87 | PGR (0.57) | SLC6A2SLC6A4SLC6A3HRH1PGR | |
| SCHEMBL5969784 | 0.82 | PGR (0.53) | SLC6A2SLC6A4SLC6A3HRH1PGR | |
| SCHEMBL15575027 | 0.82 | PGR (0.49) | SLC6A2SLC6A4SLC6A3HRH1PGR | |
| SCHEMBL15575026 | 0.82 | PGR (0.49) | SLC6A2SLC6A4SLC6A3HRH1PGR | |
| SCHEMBL942585 | 0.81 | SLC6A2 (0.69) | SLC6A2SLC6A4SLC6A3HRH1IKBKB | |
| SCHEMBL31128128 | 0.81 | SLC6A2 (0.69) | SLC6A2SLC6A4SLC6A3HRH1IKBKB | |
| SCHEMBL29595595 | 0.80 | TBK1 (0.50) | HRH1PGRIKBKBROCK1ROCK2 | |
| SCHEMBL20321365 | 0.80 | TBK1 (0.50) | HRH1PGRIKBKBROCK1ROCK2 | |
| Hydrochloric Acid SCHEMBL4107468 | 0.80 | SLC6A2 (0.67) | SLC6A2SLC6A4SLC6A3HRH1IKBKB |
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-2022048605-A1 | HETEROCYCLIC COMPOUND, PREPARATION METHOD THEREFOR, INTERMEDIATE, COMPOSITION, AND APPLICATIONS | 南昌奥瑞药业有限公司 | 2022-03-10 | — | — | WO | disclosed |