Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | POLB | P06746 | 3/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.33 |
| ▸ | PKM | P14618 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | GLA | P06280 | 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 | |
|---|---|---|---|---|
| SCHEMBL11687368 | 0.81 | POLB (0.38) | POLBCYP1A2CYP2C19MAPK1ALDH1A1 | |
| SCHEMBL11686958 | 0.81 | POLB (0.38) | POLBCYP1A2CYP2C19MAPK1ALDH1A1 | |
| SCHEMBL691564 | 0.79 | ADORA2A (0.33) | — | |
| SCHEMBL691317 | 0.78 | POLB (0.44) | POLBCYP1A2CYP2C19MAPK1ALDH1A1 | |
| SCHEMBL11747616 | 0.75 | POLB (0.41) | POLBCYP1A2CYP2C19MAPK1ALDH1A1 | |
| SCHEMBL11333878 | 0.75 | POLB (0.41) | POLBCYP1A2CYP2C19MAPK1ALDH1A1 | |
| SCHEMBL18743712 | 0.73 | POLB (0.40) | POLBCYP1A2CYP2C19MAPK1ALDH1A1 | |
| SCHEMBL11831648 | 0.72 | POLB (0.39) | POLBCYP1A2CYP2C19MAPK1ALDH1A1 | |
| SCHEMBL11687312 | 0.72 | POLB (0.43) | POLBCYP1A2CYP2C19MAPK1ALDH1A1 | |
| SCHEMBL11685425 | 0.72 | POLB (0.39) | POLBCYP1A2CYP2C19MAPK1ALDH1A1 |
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-2421537-A1 | PYRAZOLYLAMINOPYRIDINES AS INHIBITORS OF FAK | GlaxoSmithKline LLC (US) | 2012-02-29 | — | — | EP | disclosed |
| WO-2010062578-A1 | PYRAZOLYLAMINOPYRIDINES AS INHIBITORS OF FAK | GLAXOSMITHKLINE LLC (US) | 2010-06-03 | — | — | WO | disclosed |