Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRIN2B | Q13224 | 5/20 | 0.44 |
| ▸ | CTNNB1 | P35222 | 1/20 | 0.41 |
| ▸ | WNT3A | P56704 | 1/20 | 0.41 |
| ▸ | ROCK2 | O75116 | 7/20 | 0.40 |
| ▸ | ROCK1 | Q13464 | 5/20 | 0.40 |
| ▸ | CCR2 | P41597 | 2/20 | 0.40 |
| ▸ | CCR3 | P51677 | 2/20 | 0.39 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.39 |
| ▸ | NAMPT | P43490 | 1/20 | 0.39 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.39 |
| ▸ | CCNC | P24863 | 1/20 | 0.38 |
| ▸ | CDK8 | P49336 | 1/20 | 0.38 |
| ▸ | EGFR | P00533 | 1/20 | 0.38 |
| ▸ | DYRK3 | O43781 | 1/20 | 0.38 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.38 |
| ▸ | CLK2 | P49760 | 1/20 | 0.38 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.38 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.38 |
| ▸ | CSNK1G1 | Q9HCP0 | 1/20 | 0.38 |
| ▸ | STK17A | Q9UEE5 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL3701385 | 1.00 | GRIN2B (0.44) | GRIN2BCTNNB1WNT3AROCK2ROCK1 | |
| Trifluoroacetic Acid SCHEMBL3693841 | 0.95 | GRIN2B (0.41) | GRIN2BCTNNB1WNT3AROCK2ROCK1 | |
| SCHEMBL13604792 | 0.95 | GRIN2B (0.46) | GRIN2BCTNNB1WNT3AROCK2ROCK1 | |
| SCHEMBL13611679 | 0.95 | GRIN2B (0.46) | GRIN2BCTNNB1WNT3AROCK2ROCK1 | |
| Trifluoroacetic Acid SCHEMBL3700540 | 0.91 | GRIN2B (0.42) | GRIN2BCTNNB1WNT3AROCK2ROCK1 | |
| Trifluoroacetic Acid SCHEMBL3697501 | 0.91 | GRIN2B (0.42) | GRIN2BCTNNB1WNT3AROCK2ROCK1 | |
| Trifluoroacetic Acid SCHEMBL3700536 | 0.91 | GRIN2B (0.42) | GRIN2BCTNNB1WNT3AROCK2ROCK1 | |
| SCHEMBL3693003 | 0.90 | GRIN2B (0.45) | GRIN2BCTNNB1WNT3AROCK2ROCK1 | |
| SCHEMBL3696464 | 0.88 | MCHR1 (0.45) | GRIN2BCHRM5MAPK14 | |
| SCHEMBL3696469 | 0.88 | MCHR1 (0.45) | GRIN2BCHRM5MAPK14 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-101115717-A | Substituted bis aryl and heteroaryl compounds as selective 5ht2a antagonists | AVENTIS PHARMA INC (US) | 2008-01-30 | — | — | CN | claimed |
| CN-101115717-A | Substituted bis aryl and heteroaryl compounds as selective 5ht2a antagonists | AVENTIS PHARMA INC (US) | 2008-01-30 | — | — | CN | disclosed |