Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRIN1 | Q05586 | 2/20 | 0.36 |
| ▸ | GRIN2B | Q13224 | 2/20 | 0.36 |
| ▸ | PIK3C3 | Q8NEB9 | 1/20 | 0.32 |
| ▸ | AAK1 | Q2M2I8 | 4/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL22255144 | 0.84 | AAK1 (0.33) | AAK1 | |
| SCHEMBL22255600 | 0.83 | LATS1 (0.30) | — | |
| SCHEMBL22242092 | 0.81 | GRIN1 (0.32) | GRIN1GRIN2B | |
| SCHEMBL15867642 | 0.73 | NOS3 (0.40) | GRIN1GRIN2BAAK1 | |
| SCHEMBL18934316 | 0.72 | MAOA (0.43) | GRIN1GRIN2B | |
| SCHEMBL18993868 | 0.72 | GRIN1 (0.32) | GRIN1GRIN2BAAK1 | |
| SCHEMBL24400875 | 0.67 | CYP2D6 (0.33) | GRIN1GRIN2B | |
| SCHEMBL12153420 | 0.66 | — | — | |
| SCHEMBL21710072 | 0.64 | GRM4 (0.33) | GRIN1GRIN2BAAK1 | |
| SCHEMBL805491 | 0.64 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2020150674-A1 | HETEROCYCLIC COMPOUNDS AS ADENOSINE ANTAGONISTS | NUVATION BIO INC. (US) | 2020-07-23 | — | — | WO | disclosed |