Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSC | P53634 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | GLA | P06280 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | ESR1 | P03372 | 1/20 | 0.38 |
| ▸ | ESRRG | P62508 | 1/20 | 0.38 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.38 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.38 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.38 |
| ▸ | MAPK13 | O15264 | 1/20 | 0.38 |
| ▸ | MAPK12 | P53778 | 1/20 | 0.38 |
| ▸ | MAPK11 | Q15759 | 1/20 | 0.38 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.38 |
| ▸ | TEC | P42680 | 1/20 | 0.38 |
| ▸ | TXK | P42681 | 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 | |
|---|---|---|---|---|
| SCHEMBL7227405 | 0.87 | MAPK13 (0.50) | KDM4EALDH1A1GAAESR1ESRRG | |
| SCHEMBL7230944 | 0.87 | CTSS (0.44) | CTSCMAPK13MAPK12MAPK11MAPK14 | |
| SCHEMBL7223964 | 0.86 | CHRNA7 (0.42) | ALDH1A1HPGDESR1ESRRGESR2 | |
| SCHEMBL7243631 | 0.86 | CHRNA7 (0.42) | ALDH1A1HPGDESR1ESRRGESR2 | |
| SCHEMBL7224860 | 0.86 | KDM4E (0.55) | KDM4ESMN1; SMN2NPC1ALDH1A1GLA | |
| SCHEMBL7243634 | 0.86 | CHRNA7 (0.42) | ALDH1A1HPGDESR1ESRRGESR2 | |
| SCHEMBL7231998 | 0.84 | CHRNB2 (0.35) | CTSCNPC1MAPTLMNA | |
| SCHEMBL7232602 | 0.83 | CHRNA7 (0.38) | CTSCCHRNA7HTR3EHTR3BHTR3A | |
| SCHEMBL7223423 | 0.83 | SLC6A2 (0.35) | CTSCMAPTLMNA | |
| SCHEMBL7224906 | 0.82 | CHRNA7 (0.38) | KDM4ESMN1; SMN2NPC1MAPTHPGD |
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 |