Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ROS1 | P08922 | 1/20 | 0.37 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.36 |
| ▸ | TRPV1 | Q8NER1 | 2/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | GPR84 | Q9NQS5 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | MAOB | P27338 | 2/20 | 0.34 |
| ▸ | MAOA | P21397 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 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 | |
|---|---|---|---|---|
| SCHEMBL11253776 | 0.81 | ROS1 (0.41) | ROS1RPS6KB1L3MBTL1TRPV1TDP1 | |
| SCHEMBL11249519 | 0.80 | NPC1 (0.43) | ROS1RPS6KB1L3MBTL1TRPV1GPR84 | |
| SCHEMBL11261678 | 0.80 | TDP1 (0.45) | ROS1RPS6KB1TRPV1TDP1ALDH1A1 | |
| SCHEMBL11257966 | 0.78 | ROS1 (0.46) | ROS1RPS6KB1L3MBTL1TRPV1ALDH1A1 | |
| SCHEMBL11258335 | 0.77 | ALDH1A1 (0.39) | ROS1RPS6KB1TRPV1GPR84ALDH1A1 | |
| SCHEMBL11256693 | 0.77 | ALDH1A1 (0.39) | ROS1RPS6KB1TRPV1GPR84ALDH1A1 | |
| SCHEMBL9685109 | 0.77 | ALDH1A1 (0.53) | L3MBTL1ALDH1A1MAPT | |
| SCHEMBL11500393 | 0.75 | PTGDR2 (0.45) | ROS1RPS6KB1TDP1ALDH1A1MAPT | |
| SCHEMBL11261674 | 0.73 | TDO2 (0.36) | ROS1RPS6KB1GPR84ALDH1A1 | |
| SCHEMBL11259590 | 0.72 | TRPV1 (0.37) | TRPV1ALDH1A1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4337256-A | ANTIINFLAMMATORY AGENTS; ANTIAGGLOMERANTS; ENZYME INHIBITORS; ANTIULCER AGENTS | TEIKOKU HORMONE MANUFACTURING CO., LTD. (JP) | 1982-06-29 | — | — | US | disclosed |
| EP-0013411-A1 | Isoquinoline derivatives, process for their preparation and pharmaceutical compositions containing them | TEIKOKU HORMONE MFG. CO., LTD. (JP) | 1980-07-23 | — | — | EP | disclosed |