Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRIN2B | Q13224 | 4/20 | 0.47 |
| ▸ | GRIN1 | Q05586 | 3/20 | 0.47 |
| ▸ | GRIN2A | Q12879 | 3/20 | 0.47 |
| ▸ | GRIN2D | O15399 | 2/20 | 0.47 |
| ▸ | GRIN3B | O60391 | 2/20 | 0.47 |
| ▸ | ADRA1D | P25100 | 2/20 | 0.47 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.47 |
| ▸ | ADRA1B | P35368 | 2/20 | 0.47 |
| ▸ | GRIN2C | Q14957 | 2/20 | 0.47 |
| ▸ | GRIN3A | Q8TCU5 | 2/20 | 0.47 |
| ▸ | DRD4 | P21917 | 1/20 | 0.43 |
| ▸ | DPP4 | P27487 | 1/20 | 0.41 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.41 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.41 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL7700004 | 1.00 | GRIN2B (0.47) | GRIN2BGRIN1GRIN2AGRIN2DGRIN3B | |
| SCHEMBL7699990 | 1.00 | GRIN2B (0.47) | GRIN2BGRIN1GRIN2AGRIN2DGRIN3B | |
| SCHEMBL6873990 | 1.00 | GRIN2B (0.47) | GRIN2BGRIN1GRIN2AGRIN2DGRIN3B | |
| SCHEMBL7705024 | 1.00 | GRIN2B (0.47) | GRIN2BGRIN1GRIN2AGRIN2DGRIN3B | |
| SCHEMBL7896159 | 1.00 | GRIN2B (0.47) | GRIN2BGRIN1GRIN2AGRIN2DGRIN3B | |
| SCHEMBL7050156 | 0.93 | GRIN1 (0.44) | GRIN2BGRIN1GRIN2AGRIN2DGRIN3B | |
| Bromide SCHEMBL7705839 | 0.90 | GRIN2B (0.40) | GRIN2BGRIN1GRIN2AGRIN2DGRIN3B | |
| SCHEMBL6875062 | 0.87 | GRIN2B (0.42) | GRIN2BGRIN1GRIN2A | |
| SCHEMBL6880311 | 0.87 | GRIN2B (0.42) | GRIN2BGRIN1GRIN2A | |
| SCHEMBL6875060 | 0.87 | GRIN2B (0.42) | GRIN2BGRIN1GRIN2A |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1278728-B1 | PYRROLIDINE AND PIPERIDINE DERIVATIVES AND THEIR USE FOR THE TREATMENT OF NEURODEGENERATIVE DISORDERS | HOFFMANN LA ROCHE (CH) | 2004-08-25 | — | — | EP | claimed |
| US-6451819-B2 | PYRROLIDINE-3-YL-SULFANYL, OR SUFONYL OR SUFINYL DERIVATIVES USED IN THE TREATMENT OF NEURODEGENERATIVE DISEASES | HOFFMANN-LA ROCHE INC. | 2002-09-17 | — | — | US | claimed |
| US-6451819-B2 | PYRROLIDINE-3-YL-SULFANYL, OR SUFONYL OR SUFINYL DERIVATIVES USED IN THE TREATMENT OF NEURODEGENERATIVE DISEASES | HOFFMANN-LA ROCHE INC. | 2002-09-17 | — | — | US | disclosed |