Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRM1 | Q13255 | 1/20 | 0.65 |
| ▸ | KDM1A | O60341 | 2/20 | 0.39 |
| ▸ | MAOA | P21397 | 2/20 | 0.39 |
| ▸ | MAOB | P27338 | 2/20 | 0.39 |
| ▸ | ACHE | P22303 | 1/20 | 0.38 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.35 |
| ▸ | SLC6A2 | P23975 | 3/20 | 0.34 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.34 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.34 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.34 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.34 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.33 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.33 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.33 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.33 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.33 |
| ▸ | AIMP2 | Q13155 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL7679875 | 1.00 | GRM1 (0.65) | GRM1KDM1AMAOAMAOBACHE | |
| SCHEMBL7687343 | 1.00 | GRM1 (0.65) | GRM1KDM1AMAOAMAOBACHE | |
| SCHEMBL7669531 | 0.86 | GRM1 (0.61) | GRM1KDM1AMAOAMAOBHRH3 | |
| SCHEMBL7669527 | 0.86 | GRM1 (0.61) | GRM1KDM1AMAOAMAOBHRH3 | |
| SCHEMBL7422069 | 0.86 | GRM1 (0.61) | GRM1KDM1AMAOAMAOBHRH3 | |
| Hydrochloric Acid SCHEMBL7671482 | 0.85 | GRM1 (0.60) | GRM1KDM1AMAOAMAOBHRH3 | |
| Hydrochloric Acid SCHEMBL7671488 | 0.85 | GRM1 (0.60) | GRM1KDM1AMAOAMAOBHRH3 | |
| SCHEMBL7385755 | 0.81 | GRM1 (0.78) | GRM1KDM1AMAOAMAOBCYP1A2 | |
| SCHEMBL29360760 | 0.79 | GRM1 (1.00) | GRM1KDM1AMAOAMAOBCYP1A2 | |
| SCHEMBL186260 | 0.79 | GRM1 (1.00) | GRM1KDM1AMAOAMAOBCYP1A2 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6376539-B1 | ANTIISCHEMIC AGENTS, CENTRAL NERVOUS SYSTEM DISORDERS | BAYER AKTIENGESELLSCHAFT (DE) | 2002-04-23 | — | — | US | disclosed |