Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACLY | P53396 | 1/20 | 0.62 |
| ▸ | SLC16A3 | O15427 | 3/20 | 0.49 |
| ▸ | PGAM1 | P18669 | 2/20 | 0.47 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
| ▸ | PGR | P06401 | 1/20 | 0.45 |
| ▸ | RORA | P35398 | 1/20 | 0.44 |
| ▸ | RORC | P51449 | 1/20 | 0.44 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.44 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.44 |
| ▸ | MCL1 | Q07820 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | PFKFB3 | Q16875 | 1/20 | 0.43 |
| ▸ | TYMS | P04818 | 1/20 | 0.43 |
| ▸ | EDNRB | P24530 | 1/20 | 0.42 |
| ▸ | EDNRA | P25101 | 1/20 | 0.42 |
| ▸ | RECQL | P46063 | 1/20 | 0.42 |
| ▸ | PKM | P14618 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL29559690 | 0.82 | ACLY (0.43) | ACLYSLC16A3PGRMCL1PKM | |
| SCHEMBL21545890 | 0.82 | ACLY (0.43) | ACLYSLC16A3PGRMCL1PKM | |
| SCHEMBL9465779 | 0.80 | MEN1 (0.58) | TSHRALDH1A1 | |
| SCHEMBL2146366 | 0.78 | PTGES2 (0.61) | ACLY | |
| SCHEMBL9616624 | 0.77 | ALDH1A1 (0.56) | HCRTR1TSHRPGRRORARORC | |
| SCHEMBL9464328 | 0.77 | MAP2K1 (0.61) | ACLYTSHRALDH1A1HTT | |
| SCHEMBL21999593 | 0.76 | ACLY (1.00) | ACLY | |
| SCHEMBL9464387 | 0.74 | SLC40A1 (0.51) | ACLYTSHR | |
| SCHEMBL6717132 | 0.73 | ACLY (0.54) | ACLYTSHRHTT | |
| SCHEMBL2146100 | 0.73 | MCL1 (0.51) | ACLYTSHRMCL1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5258399-A | 5-lipoxygenase inhibitors | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1993-11-02 | — | — | US | disclosed |
| US-5236948-A | Lipoxygenase inhibitor | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1993-08-17 | — | — | US | disclosed |
| EP-0495594-A1 | Sulphonamide derivatives | ZENECA LIMITED (GB) | 1992-07-22 | — | — | EP | disclosed |