Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPR119 | Q8TDV5 | 1/20 | 0.39 |
| ▸ | AAK1 | Q2M2I8 | 10/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | CTSL | P07711 | 3/20 | 0.34 |
| ▸ | CTSB | P07858 | 3/20 | 0.34 |
| ▸ | CTSS | P25774 | 3/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | GLA | P06280 | 1/20 | 0.33 |
| ▸ | CTSK | P43235 | 1/20 | 0.33 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.32 |
| ▸ | USP2 | O75604 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 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 | |
|---|---|---|---|---|
| SCHEMBL5454475 | 0.88 | AAK1 (0.34) | AAK1CTSLCTSBCTSSCTSK | |
| SCHEMBL5791032 | 0.87 | GPR119 (0.40) | GPR119AAK1SMN1; SMN2CTSLCTSB | |
| SCHEMBL5311129 | 0.86 | LMNA (0.34) | AAK1CTSLCTSBCTSSCTSK | |
| SCHEMBL5804885 | 0.83 | MEN1 (0.38) | AAK1 | |
| SCHEMBL5791037 | 0.83 | CTSK (0.42) | GPR119AAK1CTSLCTSBCTSS | |
| SCHEMBL5302833 | 0.77 | CTSS (0.37) | AAK1CTSLCTSBCTSSCTSK | |
| SCHEMBL5790605 | 0.77 | CTSL (0.43) | AAK1CTSLCTSBCTSSCTSK | |
| SCHEMBL5819676 | 0.76 | CTSK (0.41) | GPR119AAK1CTSLCTSBCTSS | |
| SCHEMBL5306751 | 0.76 | STK17B (0.37) | AAK1TRPA1 | |
| SCHEMBL8268828 | 0.75 | CTSK (0.42) | GPR119AAK1CTSLCTSBCTSS |
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 |
|---|---|---|---|---|---|---|---|
| WO-2006027211-A1 | 2,4-SUBSTITUTED PYRIMIDINES AS CYSTEINE PROTEASE INHIBITORS | GLAXO GROUP LIMITED (GB) | 2006-03-16 | — | — | WO | claimed |
| WO-2006027211-A1 | 2,4-SUBSTITUTED PYRIMIDINES AS CYSTEINE PROTEASE INHIBITORS | GLAXO GROUP LIMITED (GB) | 2006-03-16 | — | — | WO | disclosed |