Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | PKM | P14618 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.30 |
| ▸ | TSHR | P16473 | 1/20 | 0.30 |
| ▸ | RAB9A | P51151 | 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 | |
|---|---|---|---|---|
| SCHEMBL8375766 | 0.85 | TSHR (0.31) | TSHR | |
| SCHEMBL8377355 | 0.82 | KDM4E (0.32) | ALDH1A1NPC1RAB9A | |
| SCHEMBL8375679 | 0.82 | NPC1 (0.31) | NPC1RAB9A | |
| SCHEMBL8377411 | 0.82 | TSHR (0.31) | TSHR | |
| SCHEMBL8376446 | 0.81 | MAPT (0.31) | ALDH1A1NPC1 | |
| SCHEMBL8378808 | 0.81 | CHRNB2 (0.33) | NPC1RAB9A | |
| SCHEMBL8377392 | 0.78 | PPARD (0.33) | — | |
| SCHEMBL8377387 | 0.78 | KCNH2 (0.30) | — | |
| SCHEMBL8377358 | 0.77 | TSHR (0.32) | ALDH1A1TSHR | |
| SCHEMBL5618290 | 0.76 | ALDH1A1 (0.38) | ALDH1A1PKMNPC1TSHRRAB9A |
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-6005116-A | HAVE INHIBITION ACTIVITIES AGAINST TYPE A-MONOAMINE OXIDASE; TREATING OR PREVENTING DEPRESSION, PARKINSON'S DISEASE, ALZEHEIMER'S DEMENTIA, OR CEREBROVASCULAR DEMENTIA | SANKYO COMPANY, LIMITED (JP) | 1999-12-21 | — | — | US | disclosed |
| EP-0885891-A1 | ISOXAZOLE DERIVATIVES | SANKYO COMPANY LIMITED (JP) | 1998-12-23 | — | — | EP | disclosed |