Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 2/20 | 0.35 |
| ▸ | MAOB | P27338 | 2/20 | 0.35 |
| ▸ | TPSAB1 | Q15661 | 1/20 | 0.33 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.32 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.32 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.31 |
| ▸ | BCHE | P06276 | 1/20 | 0.31 |
| ▸ | KCNH2 | Q12809 | 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL6976629 | 0.99 | ACHE (0.35) | ACHEMAOBTPSAB1SLC6A4SLC6A3 | |
| Hydrochloric Acid SCHEMBL6984600 | 0.91 | TPSAB1 (0.33) | ACHEMAOBTPSAB1SIGMAR1 | |
| SCHEMBL6986388 | 0.88 | SLC6A4 (0.45) | ACHEMAOBSLC6A4SLC6A3BCHE | |
| Hydrochloric Acid SCHEMBL6982769 | 0.87 | SLC6A4 (0.44) | ACHEMAOBSLC6A4SLC6A3BCHE | |
| SCHEMBL6983077 | 0.87 | SOS1 (0.39) | ACHETPSAB1SLC6A4SLC6A3SIGMAR1 | |
| SCHEMBL6980736 | 0.87 | ACHE (0.38) | ACHEMAOBTPSAB1BCHEKCNH2 | |
| Hydrochloric Acid SCHEMBL6983934 | 0.86 | SOS1 (0.39) | ACHETPSAB1SLC6A4SLC6A3SIGMAR1 | |
| SCHEMBL7983728 | 0.85 | CCR3 (0.33) | ACHEMAOBSLC6A4BCHE | |
| Hydrochloric Acid SCHEMBL6986361 | 0.84 | CCR3 (0.32) | ACHEMAOB | |
| SCHEMBL6985201 | 0.83 | EPHX2 (0.45) | TPSAB1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0923575-B1 | CYCLIC ETHER COMPOUNDS AS SODIUM CHANNEL MODULATORS | TAKEDA CHEMICAL INDUSTRIES LTD (JP) | 2003-03-12 | — | — | EP | disclosed |
| US-6172085-B1 | CENTRAL NERVOUS SYSTEM AND PSYCHOLOGICAL DISORDERS | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 2001-01-09 | — | — | US | disclosed |