Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.50 |
| ▸ | HPGD | P15428 | 4/20 | 0.50 |
| ▸ | HSP90AA1 | P07900 | 4/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.50 |
| ▸ | ALOX15 | P16050 | 3/20 | 0.50 |
| ▸ | MEN1 | O00255 | 3/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.50 |
| ▸ | TSHR | P16473 | 2/20 | 0.50 |
| ▸ | HTT | P42858 | 2/20 | 0.50 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.50 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.50 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.50 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.50 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.50 |
| ▸ | ATG4B | Q9Y4P1 | 1/20 | 0.50 |
| ▸ | ALOX12 | P18054 | 2/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 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 | |
|---|---|---|---|---|
| SCHEMBL1116671 | 0.82 | HSD17B10 (0.68) | HSD17B10HPGDHSP90AA1ALDH1A1CYP3A4 | |
| SCHEMBL6511199 | 0.81 | HSD17B10 (0.54) | HSD17B10HPGDHSP90AA1ALDH1A1CYP3A4 | |
| SCHEMBL10540494 | 0.81 | HPGD (0.67) | HSD17B10HPGDHSP90AA1ALDH1A1CYP3A4 | |
| SCHEMBL3787206 | 0.78 | CCR2 (0.46) | HSD17B10HPGDHSP90AA1ALDH1A1CYP3A4 | |
| SCHEMBL8779862 | 0.76 | ITGB2 (0.50) | HSD17B10HPGDALDH1A1CYP3A4MEN1 | |
| SCHEMBL9006588 | 0.76 | TYR (0.41) | HSD17B10HPGDALDH1A1CYP3A4ALOX15 | |
| SCHEMBL11663696 | 0.74 | ALOX15 (0.58) | HSD17B10HPGDALDH1A1ALOX15MEN1 | |
| SCHEMBL31396637 | 0.74 | CCR2 (0.44) | HSD17B10HPGDHSP90AA1ALDH1A1CYP3A4 | |
| SCHEMBL8489299 | 0.74 | CCR2 (0.44) | HSD17B10HPGDHSP90AA1ALDH1A1CYP3A4 | |
| SCHEMBL5181271 | 0.74 | MCL1 (0.48) | HSD17B10HPGDALDH1A1ALOX15MEN1 |
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-1270535-A2 | Method to synthesise substituted aromatic compounds | Clariant GmbH (DE) | 2003-01-02 | — | — | EP | disclosed |