Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BCHE | P06276 | 15/20 | 0.71 |
| ▸ | ACHE | P22303 | 6/20 | 0.71 |
| ▸ | CNR2 | P34972 | 5/20 | 0.71 |
| ▸ | CNR1 | P21554 | 4/20 | 0.71 |
| ▸ | APP | P05067 | 1/20 | 0.70 |
| ▸ | ESR1 | P03372 | 1/20 | 0.54 |
| ▸ | XDH | P47989 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL11672542 | 0.89 | APP (0.87) | BCHEACHECNR2CNR1APP | |
| SCHEMBL11729208 | 0.88 | APP (0.69) | BCHEACHECNR2CNR1APP | |
| SCHEMBL11729765 | 0.88 | BCHE (0.75) | BCHEACHECNR2CNR1APP | |
| Oxalic Acid SCHEMBL11672214 | 0.87 | APP (0.84) | BCHEACHECNR2CNR1APP | |
| SCHEMBL11672608 | 0.86 | APP (0.82) | BCHEACHECNR2CNR1APP | |
| SCHEMBL11672311 | 0.85 | APP (0.68) | BCHEACHECNR2CNR1APP | |
| SCHEMBL11673784 | 0.84 | APP (0.65) | BCHEACHECNR2CNR1APP | |
| SCHEMBL11672383 | 0.84 | APP (0.67) | BCHEACHECNR2CNR1APP | |
| SCHEMBL11671924 | 0.84 | APP (0.64) | BCHEACHECNR2CNR1APP | |
| SCHEMBL11673204 | 0.84 | APP (0.64) | BCHEACHECNR2CNR1APP |
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-4024273-A | Coronary vasodilator and anti-anginal compositions comprising substituted benzofurans and benzothiophenes and methods of producing coronary vasodilation and anti-anginal activity | SMITHKLINE CORPORATION (US) | 1977-05-17 | — | — | US | disclosed |
| US-3947470-A | CORONARY VASODILATORS, TREATMENT OF ANGINA PECTORIS | SMITHKLINE CORPORATION (US) | 1976-03-30 | — | — | US | disclosed |