Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE3B | Q13370 | 2/20 | 0.33 |
| ▸ | PDE3A | Q14432 | 2/20 | 0.33 |
| ▸ | TGM2 | P21980 | 1/20 | 0.31 |
| ▸ | CES1 | P23141 | 1/20 | 0.31 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.30 |
| ▸ | ITGAV | P06756 | 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 | |
|---|---|---|---|---|
| SCHEMBL8526080 | 0.81 | HSD17B3 (0.40) | — | |
| SCHEMBL7917615 | 0.74 | ITGB3 (0.41) | PDE3BPDE3AITGB3ITGAV | |
| SCHEMBL7917665 | 0.73 | ITGB3 (0.50) | ITGB3ITGAV | |
| SCHEMBL7917671 | 0.73 | ITGB3 (0.50) | ITGB3ITGAV | |
| Acetic Acid SCHEMBL7917029 | 0.70 | TDP2 (0.36) | PDE3BPDE3ATGM2CES1 | |
| SCHEMBL16127116 | 0.67 | PNMT (0.36) | — | |
| SCHEMBL6724247 | 0.66 | PNMT (0.37) | — | |
| SCHEMBL8551799 | 0.65 | PDE3B (0.58) | PDE3BPDE3ATGM2CES1 | |
| SCHEMBL21377284 | 0.64 | PNMT (0.41) | TGM2CES1 | |
| SCHEMBL12070481 | 0.62 | CHRM4 (0.44) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-6225465-B1 | REACTING BENZOAZEPINE OR BENZODIAZEPINE DERIVATIVE WITH PROTECTED AMINE IN PRESENCE OF PALLADIUM CATALYST IN PRESENCE OF CARBON MONOXIDE, REMOVING PROTECTING GROUPS | SMITHKLINE BEECHAM PLC (GB) | 2001-05-01 | — | — | US | disclosed |
| EP-1019383-A2 | PROCESS FOR THE AMINOCARBONYLATION OF BENZAZEPINES AND BENZODIAZEPINES | SMITHKLINE BEECHAM PLC (GB) | 2000-07-19 | — | — | EP | disclosed |
| WO-1997024336-A2 | PROCESS FOR THE AMINOCARBONYLATION OF BENZAZEPINES AND BENZODIAZEPINES | SMITHKLINE BEECHAM PLC (GB) | 1997-07-10 | — | — | WO | disclosed |