Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOA | P21397 | 1/20 | 0.48 |
| ▸ | MAOB | P27338 | 1/20 | 0.48 |
| ▸ | ACSL1 | P33121 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.35 |
| ▸ | TRPA1 | O75762 | 4/20 | 0.35 |
| ▸ | PARP1 | P09874 | 1/20 | 0.34 |
| ▸ | CD69 | Q07108 | 1/20 | 0.33 |
| ▸ | PTGER4 | P35408 | 2/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL7325719 | 0.87 | MAOA (0.52) | MAOAMAOBACSL1CYP2C9ALOX5 | |
| SCHEMBL4668382 | 0.83 | PARP1 (0.53) | MAOAMAOBCYP2C9TRPA1PARP1 | |
| SCHEMBL31069904 | 0.81 | MAOA (0.48) | MAOAMAOBACSL1CYP2C9POLB | |
| SCHEMBL27714413 | 0.79 | TRPA1 (0.54) | MAOAMAOBPOLBALOX5TRPA1 | |
| SCHEMBL10422464 | 0.78 | AHR (0.46) | CYP2C9POLBCYP2C19ALOX5TRPA1 | |
| SCHEMBL2897718 | 0.77 | PARP1 (0.34) | CYP2C9POLBCYP2C19TRPA1PARP1 | |
| SCHEMBL4668365 | 0.76 | MAOA (0.50) | MAOAMAOBCYP2C9TRPA1PARP1 | |
| SCHEMBL4668393 | 0.74 | NPC1 (0.51) | POLB | |
| SCHEMBL11797726 | 0.74 | ALDH1A1 (0.44) | CYP2C9TRPA1PARP1CD69 | |
| SCHEMBL15847696 | 0.74 | MAOA (0.47) | MAOAMAOBACSL1CYP2C9POLB |
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-5516794-A | FOR THE TREATMENT OF BONE RESORPTION | INVERNI DELLA BEEFA S.P.A. (IT) | 1996-05-14 | — | — | US | disclosed |
| EP-0586960-B1 | Xanthone derivatives, their preparation and use | INVERNI DELLA BEFFA SPA (IT) | 1996-02-07 | — | — | EP | disclosed |
| EP-0586960-A1 | Xanthone derivatives, their preparation and use | INVERNI DELLA BEFFA S.P.A. (IT) | 1994-03-16 | — | — | EP | disclosed |
| US-3948949-A | ANTIPHOLISTIC | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER (DT) | 1976-04-06 | — | — | US | disclosed |