Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALOX12 | P18054 | 3/20 | 0.50 |
| ▸ | HIF1A | Q16665 | 3/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.50 |
| ▸ | HTT | P42858 | 2/20 | 0.50 |
| ▸ | GAA | P10253 | 1/20 | 0.50 |
| ▸ | RNASEH1 | O60930 | 1/20 | 0.47 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.47 |
| ▸ | GABRB2 | P47870 | 2/20 | 0.47 |
| ▸ | TRPA1 | O75762 | 2/20 | 0.47 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.47 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.47 |
| ▸ | TYR | P14679 | 3/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 6/20 | 0.40 |
| ▸ | MAPT | P10636 | 5/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 2/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | HSP90AA1 | P07900 | 2/20 | 0.39 |
| ▸ | HSP90AB1 | P08238 | 2/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL31655440 | 0.90 | ALOX12 (0.59) | ALOX12HIF1AALDH1A1HTTGAA | |
| SCHEMBL224395 | 0.90 | ALOX12 (0.59) | ALOX12HIF1AALDH1A1HTTGAA | |
| SCHEMBL50884 | 0.79 | ALOX12 (0.57) | ALOX12HIF1AALDH1A1HTTGAA | |
| SCHEMBL4390370 | 0.79 | GABRA1 (0.48) | ALOX12HIF1AALDH1A1HTTGAA | |
| Propofol SCHEMBL8804477 | 0.79 | GABRA1 (0.63) | ALOX12HIF1AALDH1A1HTTGAA | |
| SCHEMBL1758832 | 0.78 | GABRA1 (0.47) | ALOX12HIF1AALDH1A1HTTGAA | |
| SCHEMBL5523843 | 0.78 | HIF1A (0.55) | ALOX12HIF1AALDH1A1HTTGAA | |
| SCHEMBL2202076 | 0.74 | TDP1 (0.53) | ALOX12HIF1AALDH1A1HTTGAA | |
| SCHEMBL5388682 | 0.74 | RORC (0.58) | ALOX12HIF1AALDH1A1HTTGAA | |
| SCHEMBL27751569 | 0.74 | TDP1 (0.53) | ALOX12HIF1AALDH1A1HTTGAA |
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 |
|---|---|---|---|---|---|---|---|
| US-4267394-A | SELECTIVE TO THE ORTHO POSITION, USING A COMPLEX OF BORON TRIFLUORIDE WITH A DIALKYL ETHER TO CATALYZE THE REACTION | PHILLIPS PETROLEUM COMPANY (US) | 1981-05-12 | — | — | US | disclosed |