Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | MAPT | P10636 | 2/20 | 0.42 |
| ▸ | HPGD | P15428 | 3/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | GRM5 | P41594 | 2/20 | 0.35 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.34 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.34 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.34 |
| ▸ | PTPN11 | Q06124 | 3/20 | 0.33 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.33 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.33 |
| ▸ | THRB | P10828 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 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 | |
|---|---|---|---|---|
| SCHEMBL7225781 | 0.88 | PTPN11 (0.44) | ALDH1A1MAPTLMNASMN1; SMN2GRM5 | |
| SCHEMBL7224259 | 0.88 | SLC6A3 (0.39) | ALDH1A1MAPTHPGDLMNASMN1; SMN2 | |
| SCHEMBL7230851 | 0.88 | CHRNA7 (0.35) | ALDH1A1LMNASMN1; SMN2 | |
| SCHEMBL7232697 | 0.84 | KDM4C (0.35) | ALDH1A1MAPTGRM5SLC6A3 | |
| SCHEMBL7075352 | 0.83 | NR4A1 (0.50) | ALDH1A1MAPTLMNASMN1; SMN2GAA | |
| Hydrochloric Acid SCHEMBL7072319 | 0.82 | NR4A1 (0.49) | ALDH1A1MAPTLMNASMN1; SMN2GAA | |
| SCHEMBL7225901 | 0.82 | PTPN11 (0.42) | ALDH1A1MAPTLMNASMN1; SMN2PTPN11 | |
| SCHEMBL7234113 | 0.82 | PTPN11 (0.41) | ALDH1A1MAPTHPGDLMNASMN1; SMN2 | |
| SCHEMBL7233643 | 0.80 | NPC1 (0.41) | ALDH1A1MAPTLMNASMN1; SMN2L3MBTL1 | |
| SCHEMBL7233832 | 0.79 | SLC6A3 (0.42) | ALDH1A1MAPTLMNAGRM5SLC6A3 |
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 |