Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.49 |
| ▸ | PDPK1 | O15530 | 2/20 | 0.47 |
| ▸ | RET | P07949 | 1/20 | 0.47 |
| ▸ | PI4KA | P42356 | 1/20 | 0.47 |
| ▸ | XDH | P47989 | 1/20 | 0.47 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.47 |
| ▸ | PI4K2B | Q8TCG2 | 1/20 | 0.47 |
| ▸ | PI4K2A | Q9BTU6 | 1/20 | 0.47 |
| ▸ | PI4KB | Q9UBF8 | 1/20 | 0.47 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.46 |
| ▸ | AURKA | O14965 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.46 |
| ▸ | AKT2 | P31751 | 2/20 | 0.40 |
| ▸ | MKNK1 | Q9BUB5 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.39 |
| ▸ | HPGDS | O60760 | 1/20 | 0.39 |
| ▸ | CSF1R | P07333 | 1/20 | 0.38 |
| ▸ | SLC29A1 | Q99808 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL2611044 | 0.78 | RET (0.55) | ALDH1A1PDPK1RETPI4KAXDH | |
| SCHEMBL21442708 | 0.75 | XDH (0.52) | ALDH1A1PDPK1RETPI4KAXDH | |
| SCHEMBL10226489 | 0.74 | ALDH1A1 (0.56) | ALDH1A1PDPK1RETPI4KAXDH | |
| SCHEMBL22662122 | 0.70 | CYP1A2 (0.55) | ALDH1A1PDPK1RETPI4KAXDH | |
| SCHEMBL12352811 | 0.68 | ALDH1A1 (0.53) | ALDH1A1PDPK1RETPI4KAXDH | |
| SCHEMBL21275551 | 0.68 | RET (0.52) | ALDH1A1PDPK1RETPI4KAXDH | |
| SCHEMBL2619226 | 0.67 | RET (0.61) | ALDH1A1PDPK1RETPI4KAXDH | |
| Allopurinol SCHEMBL4627 | 0.67 | XDH (0.61) | ALDH1A1PDPK1RETPI4KAXDH | |
| Allopurinol SCHEMBL4708652 | 0.67 | XDH (0.61) | ALDH1A1PDPK1RETPI4KAXDH | |
| SCHEMBL22597502 | 0.67 | XDH (0.60) | ALDH1A1PDPK1RETPI4KAXDH |
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 |
|---|---|---|---|---|---|---|---|
| EP-2283019-A1 | GPR119 RECEPTOR AGONISTS | F. Hoffmann-La Roche AG (CH) | 2011-02-16 | — | — | EP | disclosed |