Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNB2 | P17787 | 3/20 | 0.46 |
| ▸ | CHRNA4 | P43681 | 3/20 | 0.46 |
| ▸ | CHRNA7 | P36544 | 2/20 | 0.46 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | CTSS | P25774 | 1/20 | 0.41 |
| ▸ | CTSK | P43235 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.40 |
| ▸ | AKT1 | P31749 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | PTPN22 | Q9Y2R2 | 1/20 | 0.38 |
| ▸ | CDK2 | P24941 | 1/20 | 0.38 |
| ▸ | KDR | P35968 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL7223139 | 0.87 | NPC1 (0.42) | CHRNB2CHRNA4CHRNA7NPC1POLB | |
| SCHEMBL375394 | 0.87 | NPC1 (0.44) | CHRNB2CHRNA4CHRNA7NPC1POLB | |
| SCHEMBL7074460 | 0.87 | NPC1 (0.44) | CHRNB2CHRNA4CHRNA7NPC1POLB | |
| Hydrochloric Acid SCHEMBL7075781 | 0.86 | NPC1 (0.43) | CHRNB2CHRNA4CHRNA7NPC1POLB | |
| SCHEMBL7232969 | 0.84 | FAAH (0.42) | CHRNB2CHRNA4NPC1RAB9AALDH1A1 | |
| SCHEMBL7232165 | 0.84 | AKT1 (0.43) | NPC1POLBMAPK1RAB9AALDH1A1 | |
| SCHEMBL7225315 | 0.84 | AKT1 (0.39) | NPC1POLBRAB9AALDH1A1KDM4E | |
| SCHEMBL7226285 | 0.83 | NPC1 (0.44) | CHRNB2CHRNA4CHRNA7NPC1POLB | |
| SCHEMBL7224267 | 0.83 | NPC1 (0.39) | CHRNB2CHRNA4NPC1POLBRAB9A | |
| SCHEMBL7224791 | 0.82 | NPC1 (0.44) | NPC1POLBRAB9AALDH1A1KDM4E |
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 |