Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 2/20 | 0.32 |
| ▸ | CDC25A | P30304 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.30 |
| ▸ | MAPK1 | P28482 | 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 | |
|---|---|---|---|---|
| SCHEMBL29008496 | 0.83 | HPGD (0.33) | ALDH1A1KDM4ETSHRHPGD | |
| SCHEMBL29008448 | 0.81 | — | — | |
| SCHEMBL29008449 | 0.80 | CDK5 (0.31) | MAPT | |
| SCHEMBL29008483 | 0.79 | — | — | |
| SCHEMBL29008474 | 0.79 | HCAR2 (0.37) | — | |
| SCHEMBL29008463 | 0.78 | — | — | |
| SCHEMBL29008499 | 0.78 | L3MBTL1 (0.39) | ALDH1A1HPGD | |
| SCHEMBL29008471 | 0.78 | TSHR (0.37) | ALDH1A1RAB9ANPC1TSHR | |
| SCHEMBL29008461 | 0.77 | — | — | |
| SCHEMBL29008485 | 0.76 | ALDH1A1 (0.33) | ALDH1A1 |
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-116194537-A | Combination therapy with adenosine receptor antagonists | 泰昂治疗公司 | 2023-05-30 | — | — | CN | disclosed |