Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 4/20 | 0.55 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.55 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.49 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.49 |
| ▸ | POLB | P06746 | 1/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | HPGD | P15428 | 3/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.46 |
| ▸ | GLA | P06280 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.46 |
| ▸ | CASP1 | P29466 | 1/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.45 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.45 |
| ▸ | P2RY12 | Q9H244 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL18088625 | 0.84 | ALDH1A1 (0.50) | GAANPSR1HSD17B10POLBSMN1; SMN2 | |
| SCHEMBL8864697 | 0.81 | GAA (0.64) | GAANPSR1POLBSMN1; SMN2ALDH1A1 | |
| SCHEMBL11193804 | 0.80 | HPGD (0.47) | GAANPSR1KDM4EHSD17B10SMN1; SMN2 | |
| SCHEMBL12678553 | 0.76 | FFAR4 (0.40) | HSD17B10SMN1; SMN2ALDH1A1HPGDMAPT | |
| SCHEMBL7351054 | 0.76 | SMN1; SMN2 (0.50) | GAANPSR1KDM4EHSD17B10POLB | |
| SCHEMBL2037512 | 0.76 | HPGD (0.59) | GAANPSR1KDM4EHSD17B10SMN1; SMN2 | |
| SCHEMBL6490572 | 0.76 | GAA (0.57) | GAANPSR1KDM4EHSD17B10POLB | |
| SCHEMBL17973242 | 0.75 | MCL1 (0.69) | GAANPSR1KDM4EHSD17B10POLB | |
| SCHEMBL1257644 | 0.75 | KDM4E (0.56) | GAANPSR1KDM4EHSD17B10SMN1; SMN2 | |
| SCHEMBL7447346 | 0.75 | GAA (0.56) | GAANPSR1KDM4EHSD17B10SMN1; 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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5624922-A | Aryl-fused and hetaryl-fused-2,4-diazepine and 2,4-diazocine antiarrhythmic agents | STERLING WINTHROP INC. (US) | 1997-04-29 | — | — | US | disclosed |
| EP-0597540-B1 | Aryl-fused and hetaryl-fused-2,4-diazocine antiarrhythmic agents | STERLING WINTHROP INC (US) | 1996-06-05 | — | — | EP | disclosed |
| US-5380721-A | Aryl-fused and hetaryl-fused-2,4-diazepine and 2,4-diazocine antiarrhythmic agents | STERLING WINTHROP INC. (US) | 1995-01-10 | — | — | US | disclosed |
| EP-0597540-A1 | Aryl-fused and hetaryl-fused-2,4-diazocine antiarrhythmic agents | STERLING WINTHROP INC. (US) | 1994-05-18 | — | — | EP | disclosed |