Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.61 |
| ▸ | RAB9A | P51151 | 1/20 | 0.61 |
| ▸ | DYRK1A | Q13627 | 2/20 | 0.55 |
| ▸ | GSK3B | P49841 | 1/20 | 0.55 |
| ▸ | SMYD3 | Q9H7B4 | 1/20 | 0.54 |
| ▸ | USP30 | Q70CQ3 | 1/20 | 0.53 |
| ▸ | YTHDC1 | Q96MU7 | 1/20 | 0.52 |
| ▸ | CHRNA7 | P36544 | 5/20 | 0.52 |
| ▸ | HTR3A | P46098 | 4/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.52 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.52 |
| ▸ | TSHR | P16473 | 1/20 | 0.52 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.52 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.52 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.51 |
| ▸ | HTR3E | A5X5Y0 | 2/20 | 0.50 |
| ▸ | HTR3B | O95264 | 2/20 | 0.50 |
| ▸ | HTR3D | Q70Z44 | 2/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL7345995 | 1.00 | NPC1 (0.61) | NPC1RAB9ADYRK1AGSK3BSMYD3 | |
| SCHEMBL2086084 | 0.91 | NPC1 (0.67) | NPC1RAB9ADYRK1AGSK3BSMYD3 | |
| SCHEMBL12441936 | 0.89 | NPC1 (0.68) | NPC1RAB9ADYRK1AGSK3BSMYD3 | |
| Indisetron SCHEMBL18311525 | 0.89 | NPC1 (0.61) | NPC1RAB9ADYRK1AGSK3BSMYD3 | |
| SCHEMBL2086948 | 0.89 | NPC1 (0.68) | NPC1RAB9ADYRK1AGSK3BSMYD3 | |
| Indisetron SCHEMBL1073375 | 0.89 | NPC1 (0.61) | NPC1RAB9ADYRK1AGSK3BSMYD3 | |
| SCHEMBL2087490 | 0.89 | NPC1 (0.68) | NPC1RAB9ADYRK1AGSK3BSMYD3 | |
| Indisetron SCHEMBL332330 | 0.89 | NPC1 (0.61) | NPC1RAB9ADYRK1AGSK3BSMYD3 | |
| SCHEMBL8713946 | 0.89 | NPC1 (0.61) | NPC1RAB9ADYRK1AGSK3BSMYD3 | |
| Indisetron SCHEMBL29398028 | 0.89 | NPC1 (0.61) | NPC1RAB9ADYRK1AGSK3BSMYD3 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0558923-B1 | Diazabicyclo derivatives as 5-HT3 antagonists | NISSHIN FLOUR MILLING CO (JP) | 2000-05-24 | — | — | EP | disclosed |
| US-5344831-A | Antiemetics for treatment of nausea from chemotherapy | NISSHIN FLOUR MILLING CO., LTD. (JP) | 1994-09-06 | — | — | US | disclosed |
| EP-0558923-A1 | Diazabicyclo derivatives as 5-HT3 antagonists | NISSHIN FLOUR MILLING CO., LTD. (JP) | 1993-09-08 | — | — | EP | disclosed |