Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A3 | P47895 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.33 |
| ▸ | DHODH | Q02127 | 2/20 | 0.33 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.32 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.32 |
| ▸ | PTGER4 | P35408 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | GRM5 | P41594 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL24225614 | 0.81 | ALDH1A3 (0.37) | ALDH1A3ALDH1A1 | |
| SCHEMBL29287745 | 0.81 | ALDH1A3 (0.37) | ALDH1A3ALDH1A1AOC3DHODHOPRK1 | |
| SCHEMBL31533250 | 0.79 | OPRK1 (0.38) | ALDH1A3ALDH1A1AOC3OPRK1 | |
| SCHEMBL25262043 | 0.79 | OPRK1 (0.38) | ALDH1A3ALDH1A1AOC3OPRK1 | |
| SCHEMBL25218950 | 0.76 | SIRT6 (0.39) | ALDH1A3ALDH1A1AOC3 | |
| SCHEMBL25252014 | 0.76 | MELK (0.37) | ALDH1A3ALDH1A1AOC3OPRK1 | |
| SCHEMBL31533249 | 0.76 | MELK (0.37) | ALDH1A3ALDH1A1AOC3OPRK1 | |
| SCHEMBL25215055 | 0.76 | OPRK1 (0.40) | ALDH1A1AOC3DHODHOPRK1SMN1; SMN2 | |
| SCHEMBL22322258 | 0.76 | SIRT2 (0.43) | ALDH1A3ALDH1A1OPRK1 | |
| SCHEMBL22322335 | 0.76 | EGFR (0.43) | OPRK1SMN1; 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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3921319-A1 | IMIDAZO [2, 1-F] [1, 2, 4] TRIAZIN-4-AMINE DERIVATIVES AS TLR7 AGONIST | BeiGene, Ltd. (KY) | 2021-12-15 | — | — | EP | disclosed |
| CN-113423708-A | Imidazo [2,1-F ] [1,2,4] triazin-4-amine derivatives as TLR7 agonists | 百济神州有限公司 | 2021-09-21 | — | — | CN | disclosed |
| WO-2020160710-A1 | IMIDAZO [2, 1-F] [1, 2, 4] TRIAZIN-4-AMINE DERIVATIVES AS TLR7 AGONIST | BEIGENE, LTD. (KY) | 2020-08-13 | — | — | WO | disclosed |