Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACP3 | P15309 | 1/20 | 0.46 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.44 |
| ▸ | GABRB2 | P47870 | 2/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.41 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.41 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.41 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.41 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.41 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.41 |
| ▸ | GRIN3A | Q8TCU5 | 1/20 | 0.41 |
| ▸ | PGK1 | P00558 | 3/20 | 0.39 |
| ▸ | PGK2 | P07205 | 3/20 | 0.39 |
| ▸ | MMP2 | P08253 | 2/20 | 0.34 |
| ▸ | MMP9 | P14780 | 2/20 | 0.34 |
| ▸ | MMP12 | P39900 | 2/20 | 0.34 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.33 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL1556934 | 0.85 | ACP3 (0.52) | ACP3GABRA1GABRB2SMN1; SMN2GRIN2D | |
| SCHEMBL8009692 | 0.81 | GABRA1 (0.58) | GABRA1GABRB2RIPK1 | |
| SCHEMBL1293279 | 0.79 | GABRA1 (0.40) | GABRA1GABRB2 | |
| Butane SCHEMBL3092282 | 0.79 | ACP3 (0.49) | ACP3GABRA1GABRB2GRIN2DGRIN3B | |
| SCHEMBL21638770 | 0.78 | ACP3 (0.52) | ACP3GABRA1GABRB2SMN1; SMN2GRIN2D | |
| SCHEMBL2420219 | 0.77 | ACP3 (0.55) | ACP3SMN1; SMN2GRIN2DGRIN3BGRIN1 | |
| SCHEMBL1294030 | 0.76 | GABRA1 (0.46) | GABRA1GABRB2RIPK1 | |
| SCHEMBL11499183 | 0.75 | ACP3 (0.57) | ACP3GABRA1GABRB2SMN1; SMN2GRIN2D | |
| SCHEMBL6243179 | 0.74 | AKR1B1 (0.46) | GABRA1GABRB2GRIN2DGRIN3BGRIN1 | |
| SCHEMBL1293367 | 0.74 | GABRA1 (0.48) | GABRA1GABRB2RIPK1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2563785-A1 | COMPOUNDS AS AGONISTS OF S1P1 RECEPTORS | Glaxo Group Limited (GB) | 2013-03-06 | — | — | EP | disclosed |
| US-8389508-B2 | Heterocyclic compounds | GLAXO GROUP LIMITED (GB) | 2013-03-05 | — | — | US | disclosed |