Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A4 | P31645 | 5/20 | 0.38 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.37 |
| ▸ | SLC6A2 | P23975 | 3/20 | 0.35 |
| ▸ | SLC6A3 | Q01959 | 3/20 | 0.35 |
| ▸ | IKBKB | O14920 | 1/20 | 0.35 |
| ▸ | HTR2C | P28335 | 2/20 | 0.35 |
| ▸ | HTR2B | P41595 | 2/20 | 0.35 |
| ▸ | HRH1 | P35367 | 1/20 | 0.35 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.33 |
| ▸ | HTR6 | P50406 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL28632585 | 1.00 | SLC6A4 (0.38) | SLC6A4P2RX7SLC6A2SLC6A3IKBKB | |
| SCHEMBL29987275 | 0.81 | SLC6A4 (0.42) | SLC6A4SLC6A2SLC6A3KCNH2 | |
| SCHEMBL29987483 | 0.79 | MAPK14 (0.33) | — | |
| SCHEMBL11908109 | 0.69 | HRH1 (0.44) | SLC6A4SLC6A2SLC6A3IKBKBHRH1 | |
| SCHEMBL30986478 | 0.69 | HRH1 (0.44) | SLC6A4SLC6A2SLC6A3IKBKBHRH1 | |
| SCHEMBL20412703 | 0.68 | HRH1 (0.47) | P2RX7SLC6A2SLC6A3IKBKBHTR2C | |
| SCHEMBL5461353 | 0.68 | TDO2 (0.42) | SLC6A4SLC6A2IKBKBHRH1ROCK1 | |
| SCHEMBL28679074 | 0.68 | P2RX7 (0.41) | SLC6A4P2RX7SLC6A2IKBKBHRH1 | |
| Hydrochloric Acid SCHEMBL28677440 | 0.67 | HRH1 (0.46) | P2RX7SLC6A2SLC6A3IKBKBHTR2C | |
| SCHEMBL17303549 | 0.67 | P2RX7 (0.40) | P2RX7IKBKBHRH1KCNH2SMN1; SMN2 |
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-113278013-B | 2, 6-disubstituted 1,2, 4-triazine-3, 5-diketone compound and preparation method and application thereof | 昆药集团股份有限公司 | 2022-09-23 | — | — | CN | disclosed |