Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C3 | P42330 | 2/20 | 0.57 |
| ▸ | AKR1C2 | P52895 | 2/20 | 0.57 |
| ▸ | GAA | P10253 | 3/20 | 0.52 |
| ▸ | LMNA | P02545 | 3/20 | 0.52 |
| ▸ | HTT | P42858 | 2/20 | 0.52 |
| ▸ | NPC1 | O15118 | 1/20 | 0.52 |
| ▸ | TP53 | P04637 | 1/20 | 0.52 |
| ▸ | CDC25B | P30305 | 3/20 | 0.51 |
| ▸ | AKR1B10 | O60218 | 1/20 | 0.50 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.50 |
| ▸ | AKR1C4 | P17516 | 1/20 | 0.50 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.50 |
| ▸ | MAPT | P10636 | 2/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 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 | |
|---|---|---|---|---|
| SCHEMBL25449209 | 0.90 | AKR1C3 (0.66) | AKR1C3AKR1C2LMNACDC25BAKR1B10 | |
| SCHEMBL10525020 | 0.82 | AKR1C3 (0.73) | AKR1C3AKR1C2LMNACDC25BAKR1B10 | |
| SCHEMBL2114188 | 0.82 | CDC25B (0.72) | AKR1C3AKR1C2GAALMNAHTT | |
| SCHEMBL5321483 | 0.81 | AKR1C3 (0.57) | AKR1C3AKR1C2GAALMNAHTT | |
| SCHEMBL29050677 | 0.79 | AKR1C3 (0.57) | AKR1C3AKR1C2LMNANPC1AKR1B10 | |
| SCHEMBL30567367 | 0.78 | MAPT (0.68) | AKR1C3AKR1C2AKR1B10AKR1B1AKR1C4 | |
| SCHEMBL848485 | 0.78 | MAPT (0.68) | AKR1C3AKR1C2AKR1B10AKR1B1AKR1C4 | |
| SCHEMBL304891 | 0.78 | CXCR2 (0.54) | GAALMNAHTTNPC1TP53 | |
| SCHEMBL10936401 | 0.78 | MEN1 (0.58) | AKR1C3AKR1C2GAALMNAMAPT | |
| SCHEMBL40865 | 0.77 | KDM4E (0.61) | GAALMNAHTTNPC1TP53 |
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-4539429-A | LIPOXYGENASE INHIBITORS, ANTIASTHMA | STERLING DRUG INC. (US) | 1985-09-03 | — | — | US | disclosed |