Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM4 | P08173 | 1/20 | 0.41 |
| ▸ | CHRNA7 | P36544 | 2/20 | 0.39 |
| ▸ | KDM1A | O60341 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | HTR3A | P46098 | 2/20 | 0.37 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.37 |
| ▸ | HTR3B | O95264 | 1/20 | 0.37 |
| ▸ | HTR3D | Q70Z44 | 1/20 | 0.37 |
| ▸ | HTR3C | Q8WXA8 | 1/20 | 0.37 |
| ▸ | HCRTR1 | O43613 | 3/20 | 0.37 |
| ▸ | HCRTR2 | O43614 | 2/20 | 0.37 |
| ▸ | FAAH | O00519 | 1/20 | 0.36 |
| ▸ | CNR2 | P34972 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL7230427 | 0.86 | CNR1 (0.36) | CHRNA7NPC1RAB9AHTR3AHTR3E | |
| SCHEMBL7223372 | 0.86 | RIPK1 (0.36) | KDM1AHTR3AHTR3EHTR3BHTR3D | |
| SCHEMBL7223552 | 0.86 | NPC1 (0.38) | CHRNA7NPC1RAB9AHTR3AHTR3E | |
| SCHEMBL7234242 | 0.83 | HDAC3 (0.47) | CHRNA7KDM1ANPC1RAB9AHTR3A | |
| SCHEMBL7233563 | 0.83 | HCRTR1 (0.40) | NPC1RAB9AHCRTR1HCRTR2FAAH | |
| SCHEMBL7231066 | 0.80 | KDM4E (0.39) | CHRNA7NPC1RAB9AHTR3AHTR3E | |
| SCHEMBL7232275 | 0.79 | CHRNA7 (0.62) | CHRNA7HTR3AHTR3EHTR3BHTR3D | |
| SCHEMBL7233270 | 0.79 | HDAC3 (0.48) | CHRNA7KDM1ANPC1RAB9AHTR3A | |
| SCHEMBL7230824 | 0.79 | CHRNB2 (0.39) | NPC1RAB9AHCRTR1HCRTR2CNR2 | |
| SCHEMBL7224821 | 0.79 | CTSK (0.37) | HCRTR1HCRTR2FAAH |
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-6562816-B2 | Alpha 7 nicotine acetylcholine receptor agonist anti-psychotic agent, with reduced side effects | PHARMACIA & UPJOHN COMPANY | 2003-05-13 | — | — | US | claimed |
| US-6562816-B2 | Alpha 7 nicotine acetylcholine receptor agonist anti-psychotic agent, with reduced side effects | PHARMACIA & UPJOHN COMPANY | 2003-05-13 | — | — | US | disclosed |