Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRIN1 | Q05586 | 9/20 | 0.59 |
| ▸ | GRIN2A | Q12879 | 9/20 | 0.59 |
| ▸ | GRIN2D | O15399 | 8/20 | 0.59 |
| ▸ | GRIN3B | O60391 | 8/20 | 0.59 |
| ▸ | GRIN2B | Q13224 | 8/20 | 0.59 |
| ▸ | GRIN2C | Q14957 | 8/20 | 0.59 |
| ▸ | GRIN3A | Q8TCU5 | 8/20 | 0.59 |
| ▸ | MEN1 | O00255 | 2/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.51 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | HTT | P42858 | 2/20 | 0.40 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.40 |
| ▸ | ESR1 | P03372 | 1/20 | 0.40 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.40 |
| ▸ | ACHE | P22303 | 1/20 | 0.40 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.40 |
| ▸ | MTOR | P42345 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL1715069 | 0.74 | GRIN1 (1.00) | GRIN1GRIN2AGRIN2DGRIN3BGRIN2B | |
| SCHEMBL14696219 | 0.74 | GRIN1 (0.66) | GRIN1GRIN2AGRIN2DGRIN3BGRIN2B | |
| SCHEMBL1239132 | 0.74 | GRIN2D (0.50) | GRIN1GRIN2AGRIN2DGRIN3BGRIN2B | |
| Hydrochloric Acid SCHEMBL7113114 | 0.73 | GRIN1 (0.59) | GRIN1GRIN2AGRIN2DGRIN3BGRIN2B | |
| Iodide SCHEMBL1714838 | 0.73 | GRIN2D (0.48) | GRIN1GRIN2AGRIN2DGRIN3BGRIN2B | |
| SCHEMBL11702337 | 0.72 | GRIN1 (0.68) | GRIN1GRIN2AGRIN2DGRIN3BGRIN2B | |
| SCHEMBL14696291 | 0.72 | GRIN1 (0.79) | GRIN1GRIN2AGRIN2DGRIN3BGRIN2B | |
| SCHEMBL1713895 | 0.71 | GRIN1 (0.56) | GRIN1GRIN2AGRIN2DGRIN3BGRIN2B | |
| SCHEMBL15373723 | 0.71 | GRIN1 (0.60) | GRIN1GRIN2AGRIN2DGRIN3BGRIN2B | |
| SCHEMBL14696763 | 0.70 | GRIN1 (0.76) | GRIN1GRIN2AGRIN2DGRIN3BGRIN2B |
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 |
|---|---|---|---|---|---|---|---|
| EP-1512679-B1 | Novel adamantane derivatives with neuroprotective, antidepressant and anti-ischaemic activities, and process for preparing them | ROTTAPHARM SPA (IT) | 2011-07-20 | — | — | EP | disclosed |