Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 5/20 | 0.61 |
| ▸ | ELANE | P08246 | 5/20 | 0.61 |
| ▸ | MAPT | P10636 | 1/20 | 0.51 |
| ▸ | POLB | P06746 | 1/20 | 0.48 |
| ▸ | LMNA | P02545 | 2/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | TRPC5 | Q9UL62 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.46 |
| ▸ | CA12 | O43570 | 1/20 | 0.45 |
| ▸ | CA1 | P00915 | 1/20 | 0.45 |
| ▸ | CA2 | P00918 | 1/20 | 0.45 |
| ▸ | CA7 | P43166 | 1/20 | 0.45 |
| ▸ | CA9 | Q16790 | 1/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.43 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL8344050 | 0.90 | MAPT (0.62) | CYP2C9ELANEMAPTPOLBLMNA | |
| SCHEMBL13412241 | 0.85 | MAPT (0.69) | CYP2C9ELANEMAPTALDH1A1HTT | |
| SCHEMBL8050837 | 0.83 | ELANE (0.79) | CYP2C9ELANEMAPTPOLBLMNA | |
| SCHEMBL2888375 | 0.79 | ELANE (0.69) | CYP2C9ELANEMAPTLMNATSHR | |
| SCHEMBL8220635 | 0.78 | ELANE (0.70) | CYP2C9ELANEMAPTLMNAALDH1A1 | |
| SCHEMBL2888564 | 0.78 | ELANE (0.79) | CYP2C9ELANEMAPTLMNAALDH1A1 | |
| SCHEMBL9914387 | 0.78 | ELANE (0.79) | CYP2C9ELANEMAPTPOLBLMNA | |
| SCHEMBL2887923 | 0.78 | ELANE (0.79) | CYP2C9ELANEMAPTLMNAALDH1A1 | |
| SCHEMBL2894486 | 0.77 | ELANE (0.78) | CYP2C9ELANEMAPTPOLBLMNA | |
| SCHEMBL2896028 | 0.77 | ELANE (0.77) | CYP2C9ELANEMAPTPOLBLMNA |
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-2004024700-A1 | PYRIMIDINONE DERIVATIVES AS THERAPEUTIC AGENTS AGAINST ACUTE AND CHRONIC INFLAMMATORY, ISCHAEMIC AND REMODELLING PROCESSES | BAYER HEALTHCARE AG (DE) | 2004-03-25 | — | — | WO | disclosed |