Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ROCK1 | Q13464 | 1/20 | 0.50 |
| ▸ | CXCR3 | P49682 | 11/20 | 0.37 |
| ▸ | LPL | P06858 | 2/20 | 0.37 |
| ▸ | LIPG | Q9Y5X9 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | BACE1 | P56817 | 2/20 | 0.35 |
| ▸ | BCHE | P06276 | 1/20 | 0.35 |
| ▸ | ACHE | P22303 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | PDE2A | O00408 | 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 | |
|---|---|---|---|---|
| SCHEMBL3263593 | 1.00 | ROCK1 (0.50) | ROCK1CXCR3LPLLIPGALDH1A1 | |
| SCHEMBL3264764 | 0.93 | ROCK1 (0.52) | ROCK1CXCR3LPLLIPGALDH1A1 | |
| SCHEMBL18580506 | 0.91 | ROCK1 (0.48) | ROCK1CXCR3LPLLIPGALDH1A1 | |
| SCHEMBL2563557 | 0.88 | ROCK1 (0.48) | ROCK1CXCR3LPLLIPGALDH1A1 | |
| SCHEMBL19211744 | 0.84 | KDM4E (0.52) | ROCK1CXCR3LPLLIPGALDH1A1 | |
| SCHEMBL15648487 | 0.83 | ROCK1 (0.52) | ROCK1LPLLIPGALDH1A1TDP1 | |
| SCHEMBL18580183 | 0.83 | ROCK1 (0.45) | ROCK1CXCR3ALDH1A1TDP1KDM4E | |
| SCHEMBL21644162 | 0.83 | KDM4E (0.55) | ROCK1CXCR3LPLLIPGALDH1A1 | |
| SCHEMBL18579955 | 0.81 | ROCK1 (0.53) | ROCK1LPLLIPGALDH1A1TDP1 | |
| SCHEMBL428922 | 0.81 | CYP2A13 (0.50) | ROCK1LPLLIPGALDH1A1KDM4E |
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-2010010184-A1 | [1, 2, 4] TRIAZOLO [1, 5-A] PYRIDINES AS JAK INHIBITORS | GALAPAGOS NV (BE) | 2010-01-28 | — | — | WO | disclosed |