Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRIN1 | Q05586 | 14/20 | 0.81 |
| ▸ | GRIN2B | Q13224 | 14/20 | 0.81 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.36 |
| ▸ | CDK5R1 | Q15078 | 1/20 | 0.36 |
| ▸ | NR1I3 | Q14994 | 1/20 | 0.36 |
| ▸ | STS | P08842 | 1/20 | 0.33 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.32 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.32 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.32 |
| ▸ | MBOAT4 | Q96T53 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL19253188 | 1.00 | GRIN1 (0.81) | GRIN1GRIN2BCDK5CDK5R1NR1I3 | |
| SCHEMBL19253189 | 0.90 | GRIN1 (1.00) | GRIN1GRIN2BGRIN2DGRIN2AGRIN2C | |
| SCHEMBL6853527 | 0.83 | GRIN1 (0.68) | GRIN1GRIN2BCDK5CDK5R1NR1I3 | |
| SCHEMBL4605996 | 0.81 | GRIN1 (0.68) | GRIN1GRIN2BCDK5CDK5R1NR1I3 | |
| SCHEMBL1325195 | 0.80 | GRIN1 (0.67) | GRIN1GRIN2BCDK5CDK5R1NR1I3 | |
| SCHEMBL19253181 | 0.77 | GRIN1 (0.82) | GRIN1GRIN2BCDK5CDK5R1NR1I3 | |
| SCHEMBL19253232 | 0.77 | GRIN1 (0.82) | GRIN1GRIN2BCDK5CDK5R1NR1I3 | |
| SCHEMBL19733259 | 0.77 | GRIN1 (0.82) | GRIN1GRIN2BCDK5CDK5R1NR1I3 | |
| SCHEMBL19253162 | 0.77 | GRIN1 (0.82) | GRIN1GRIN2BCDK5CDK5R1NR1I3 | |
| SCHEMBL30645499 | 0.76 | GRIN1 (0.58) | GRIN1GRIN2BCDK5CDK5R1NR1I3 |
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-3260462-A1 | AMPHIPHILIC COMPOUNDS WITH NEUROPROTECTIVE PROPERTIES | Ustav Organicke Chemie A Biochemie Av Cr, V.v.i. (CZ) | 2017-12-27 | — | — | EP | disclosed |