Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 8/20 | 0.50 |
| ▸ | RAB9A | P51151 | 8/20 | 0.50 |
| ▸ | MAPT | P10636 | 3/20 | 0.50 |
| ▸ | TP53 | P04637 | 2/20 | 0.50 |
| ▸ | HTT | P42858 | 2/20 | 0.50 |
| ▸ | HDAC6 | Q9UBN7 | 4/20 | 0.48 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.46 |
| ▸ | MEN1 | O00255 | 3/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | ASIC1 | P78348 | 1/20 | 0.43 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.43 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.43 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.43 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.43 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL8375802 | 0.83 | ALDH1A1 (0.61) | NPC1RAB9AMAPTTP53HDAC6 | |
| SCHEMBL6938529 | 0.80 | NOTUM (0.61) | NPC1RAB9AMAPTTP53TDP1 | |
| SCHEMBL788874 | 0.80 | ALDH1A1 (0.44) | NPC1RAB9AMAPTTP53KMT2A | |
| SCHEMBL8380106 | 0.80 | RAB9A (0.57) | NPC1RAB9AMAPTPTGS2TDP1 | |
| SCHEMBL2959768 | 0.80 | NPC1 (0.56) | NPC1RAB9AMAPTTP53HTT | |
| SCHEMBL38657732 | 0.80 | PTPN1 (0.61) | NPC1RAB9AMAPTTP53HTT | |
| SCHEMBL8378877 | 0.79 | TRPV1 (0.50) | NPC1RAB9AMAPTKMT2AMEN1 | |
| SCHEMBL5157687 | 0.79 | RAB9A (0.61) | NPC1RAB9AMAPTPTGS2TDP1 | |
| SCHEMBL38658113 | 0.78 | ALDH1A1 (0.43) | NPC1RAB9ATP53HDAC6TDP1 | |
| SCHEMBL21121779 | 0.78 | HSD17B1 (0.64) | NPC1RAB9AMAPTTP53HTT |
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 |
|---|---|---|---|---|---|---|---|
| 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 |
| CN-1216986-A | Isoxazole derivatives | SANKYO CO (JP) | 1999-05-19 | — | — | CN | disclosed |
| EP-0885891-A1 | ISOXAZOLE DERIVATIVES | SANKYO COMPANY LIMITED (JP) | 1998-12-23 | — | — | EP | disclosed |