Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.66 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.66 |
| ▸ | HPGD | P15428 | 2/20 | 0.66 |
| ▸ | MDM2 | Q00987 | 2/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | PLA2G10 | O15496 | 1/20 | 0.47 |
| ▸ | GAA | P10253 | 1/20 | 0.47 |
| ▸ | XDH | P47989 | 2/20 | 0.46 |
| ▸ | TYMP | P19971 | 3/20 | 0.46 |
| ▸ | TAS2R38 | P59533 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.46 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.46 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.46 |
| ▸ | SIRT3 | Q9NTG7 | 1/20 | 0.46 |
| ▸ | SIRT5 | Q9NXA8 | 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 | |
|---|---|---|---|---|
| SCHEMBL7092828 | 0.90 | ALDH1A1 (0.55) | HSD17B10ALDH1A1HPGDMDM2KDM4E | |
| SCHEMBL7093919 | 0.90 | ALDH1A1 (0.55) | HSD17B10ALDH1A1HPGDMDM2KDM4E | |
| SCHEMBL7091477 | 0.90 | POLB (0.56) | HSD17B10ALDH1A1HPGDMDM2XDH | |
| SCHEMBL7094140 | 0.86 | ALDH1A1 (0.51) | HSD17B10ALDH1A1HPGDMDM2GAA | |
| SCHEMBL7093922 | 0.86 | ALDH1A1 (0.51) | HSD17B10ALDH1A1HPGDMDM2KDM4E | |
| SCHEMBL7093329 | 0.86 | HSD17B10 (0.51) | HSD17B10ALDH1A1HPGDMDM2XDH | |
| SCHEMBL7090564 | 0.85 | PTGS2 (0.60) | HSD17B10ALDH1A1HPGD | |
| SCHEMBL7092623 | 0.85 | PTGS2 (0.60) | HSD17B10ALDH1A1HPGD | |
| SCHEMBL7090047 | 0.85 | PTGS2 (0.60) | HSD17B10ALDH1A1HPGD | |
| SCHEMBL1572915 | 0.80 | ALDH1A1 (0.68) | HSD17B10ALDH1A1HPGDKDM4EPLA2G10 |
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-2003084935-A2 | DIARYL PYRIMIDINONE DERIVATIVES USEFUL FOR THE TREATMENT OF INFLAMMATION AND IMMUNOGOLICAL DISEASES | ORCHID CHEMICALS & PHARMACEUTICALS LTD (IN) | 2003-10-16 | — | — | WO | disclosed |