Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.55 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.54 |
| ▸ | LMNA | P02545 | 1/20 | 0.54 |
| ▸ | CA12 | O43570 | 2/20 | 0.53 |
| ▸ | CA1 | P00915 | 2/20 | 0.53 |
| ▸ | CA2 | P00918 | 2/20 | 0.53 |
| ▸ | CA4 | P22748 | 2/20 | 0.53 |
| ▸ | CA7 | P43166 | 2/20 | 0.53 |
| ▸ | CA9 | Q16790 | 2/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.52 |
| ▸ | DRD2 | P14416 | 4/20 | 0.51 |
| ▸ | DRD4 | P21917 | 1/20 | 0.48 |
| ▸ | DRD3 | P35462 | 1/20 | 0.48 |
| ▸ | CKS1B | P61024 | 2/20 | 0.47 |
| ▸ | SKP1 | P63208 | 2/20 | 0.47 |
| ▸ | SKP2 | Q13309 | 2/20 | 0.47 |
| ▸ | GPR119 | Q8TDV5 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL13890887 | 0.86 | LMNA (0.55) | ALDH1A1EPHX2LMNACA12CA1 | |
| SCHEMBL1908729 | 0.86 | CKS1B (0.56) | ALDH1A1EPHX2LMNACA12CA1 | |
| SCHEMBL1908744 | 0.86 | LMNA (0.55) | ALDH1A1EPHX2LMNACA12CA1 | |
| SCHEMBL13449930 | 0.85 | LMNA (0.57) | ALDH1A1EPHX2LMNACA12CA1 | |
| SCHEMBL12015977 | 0.84 | CA12 (0.55) | ALDH1A1EPHX2LMNACA12CA1 | |
| SCHEMBL359214 | 0.84 | CA12 (0.55) | ALDH1A1EPHX2LMNACA12CA1 | |
| SCHEMBL2001966 | 0.83 | ALDH1A1 (0.60) | ALDH1A1LMNACA12CA1CA2 | |
| SCHEMBL13879006 | 0.83 | LMNA (0.53) | ALDH1A1EPHX2LMNACA12CA1 | |
| SCHEMBL2301058 | 0.82 | CKS1B (0.60) | ALDH1A1LMNACA12CA1CA2 | |
| SCHEMBL1919795 | 0.82 | ALDH1A1 (0.58) | ALDH1A1LMNACA12CA1CA2 |
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-2012759-A1 | PURINE DERIVATIVES AS A2A RECEPTOR AGONISTS | Novartis AG (CH) | 2009-01-14 | — | — | EP | disclosed |
| WO-2007121923-A1 | PURINE DERIVATIVES AS A2A RECEPTOR AGONISTS | NOVARTIS AG (CH) | 2007-11-01 | — | — | WO | disclosed |