Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.44 |
| ▸ | BRD4 | O60885 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 3/20 | 0.42 |
| ▸ | MAPT | P10636 | 3/20 | 0.42 |
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
| ▸ | HPGD | P15428 | 2/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.42 |
| ▸ | MPI | P34949 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.39 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.39 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.39 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.39 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.39 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL9344178 | 0.87 | ALDH1A1 (0.42) | ALDH1A1BRD4GAALMNAHPGD | |
| SCHEMBL27188920 | 0.85 | BRD4 (0.43) | ALDH1A1BRD4GAAMAPTLMNA | |
| SCHEMBL16153701 | 0.85 | ALDH1A1 (0.41) | ALDH1A1BRD4GAAMAPTHPGD | |
| SCHEMBL13923793 | 0.83 | BRD4 (0.41) | ALDH1A1BRD4GAAMAPTLMNA | |
| SCHEMBL9937345 | 0.83 | OPRM1 (0.39) | ALDH1A1BRD4GAAMAPTLMNA | |
| SCHEMBL6250430 | 0.81 | ALDH1A1 (0.44) | ALDH1A1GAAMAPTLMNAHPGD | |
| SCHEMBL15016426 | 0.80 | NPC1 (0.40) | ALDH1A1MAPTHPGDSMN1; SMN2MEN1 | |
| SCHEMBL1990722 | 0.80 | BRD4 (0.45) | ALDH1A1BRD4GAAMAPTLMNA | |
| SCHEMBL9344111 | 0.79 | ALDH1A1 (0.42) | ALDH1A1BRD4GAALMNAHPGD | |
| SCHEMBL19838777 | 0.78 | BRD4 (0.52) | ALDH1A1BRD4GAAMAPTLMNA |
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-6699909-B1 | MODULATORS OF METABOTROPIC GLUTAMATE RECEPTORS; CENTRAL NERVOUS SYSTEM DISORDERS | PRESCIENT NEUROPHARMA INC. (CA) | 2004-03-02 | — | — | US | disclosed |