Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIK3CD | O00329 | 2/20 | 0.41 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | PIP5K1C | O60331 | 1/20 | 0.36 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.36 |
| ▸ | PI4KA | P42356 | 1/20 | 0.36 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.36 |
| ▸ | PI4KB | Q9UBF8 | 1/20 | 0.36 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | PTGS2 | P35354 | 3/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.35 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.35 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.35 |
| ▸ | FAAH | O00519 | 1/20 | 0.34 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL26106996 | 0.84 | PIK3CD (0.48) | PIK3CDCYP2A6SMN1; SMN2MAPTPIP5K1C | |
| SCHEMBL422105 | 0.78 | SIRT6 (0.38) | PIK3CDSMN1; SMN2MAPTPIP5K1CPIK3CB | |
| SCHEMBL19260832 | 0.73 | CA12 (0.36) | PIK3CDSMN1; SMN2PIP5K1CPIK3CBPI4KA | |
| SCHEMBL31002433 | 0.72 | ALOX5AP (0.38) | PTGS2 | |
| SCHEMBL26107943 | 0.72 | PI4KB (0.55) | PIK3CDPIP5K1CPIK3CBPI4KAPIK3CG | |
| SCHEMBL21266740 | 0.72 | PIK3CD (0.66) | PIK3CDCYP2A6PIK3CBPIK3CGNOTUM | |
| SCHEMBL6050864 | 0.69 | PTGS2 (0.60) | PTGS2PTGS1ABCC4ABCB11PDE4D | |
| SCHEMBL29977958 | 0.69 | SMN1; SMN2 (0.59) | SMN1; SMN2MAPTALDH1A1MAPK1MEN1 | |
| SCHEMBL1256644 | 0.69 | SMN1; SMN2 (0.59) | SMN1; SMN2MAPTALDH1A1MAPK1MEN1 | |
| SCHEMBL1662273 | 0.69 | PIK3CD (0.73) | PIK3CDCYP2A6NOTUMALDH1A1NPC1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2133340-B1 | Novel benzazepine derivatives | GLAXO GROUP LTD (GB) | 2013-01-16 | — | — | EP | disclosed |
| EP-2133340-A1 | Novel benzazepine derivatives | Glaxo Group Limited (GB) | 2009-12-16 | — | — | EP | disclosed |
| CN-1326838-C | Benzo[d]azepine derivatives for the treatment of neurological disorders | GLAXO GROUP LTD (GB) | 2007-07-18 | — | — | CN | disclosed |
| CN-1726042-A | Benzo[d]azepine derivatives for the treatment of neurological disorders | GLAXO GROUP LTD (GB) | 2006-01-25 | — | — | CN | disclosed |