Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKT1 | P31749 | 5/20 | 0.36 |
| ▸ | CHRNA7 | P36544 | 9/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.34 |
| ▸ | NPC1 | O15118 | 2/20 | 0.34 |
| ▸ | RAB9A | P51151 | 2/20 | 0.34 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | HTR3E | A5X5Y0 | 5/20 | 0.34 |
| ▸ | HTR3B | O95264 | 5/20 | 0.34 |
| ▸ | HTR3A | P46098 | 5/20 | 0.34 |
| ▸ | HTR3D | Q70Z44 | 5/20 | 0.34 |
| ▸ | HTR3C | Q8WXA8 | 5/20 | 0.34 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.33 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.33 |
| ▸ | ESR1 | P03372 | 1/20 | 0.32 |
| ▸ | ESRRG | P62508 | 1/20 | 0.32 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL7226198 | 0.88 | CHRNA7 (0.34) | AKT1CHRNA7KDM4ENPC1RAB9A | |
| SCHEMBL7226155 | 0.85 | CHRNA7 (0.36) | AKT1CHRNA7KDM4ENPC1RAB9A | |
| SCHEMBL7231059 | 0.83 | ALDH1A1 (0.38) | AKT1CHRNA7KDM4ENPC1RAB9A | |
| SCHEMBL7223884 | 0.82 | ESR1 (0.36) | AKT1CHRNA7KDM4ENPC1RAB9A | |
| SCHEMBL7224518 | 0.82 | CHRNA7 (0.41) | AKT1CHRNA7KDM4ENPC1RAB9A | |
| SCHEMBL7234082 | 0.82 | CHRNB2 (0.32) | AKT1CHRNB2CHRNA4 | |
| SCHEMBL7233242 | 0.82 | AKT1 (0.36) | AKT1CHRNA7HPGDHTR3EHTR3B | |
| SCHEMBL7232306 | 0.82 | CHRNA7 (0.39) | AKT1CHRNA7KDM4ENPC1RAB9A | |
| SCHEMBL7234365 | 0.82 | — | — | |
| SCHEMBL7223682 | 0.81 | AKT1 (0.40) | AKT1CHRNA7KDM4ENPC1RAB9A |
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 |