Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C3 | P42330 | 5/20 | 0.56 |
| ▸ | AKR1C2 | P52895 | 5/20 | 0.56 |
| ▸ | AKR1C4 | P17516 | 3/20 | 0.52 |
| ▸ | AKR1C1 | Q04828 | 3/20 | 0.52 |
| ▸ | AKR1B10 | O60218 | 2/20 | 0.52 |
| ▸ | AKR1B1 | P15121 | 2/20 | 0.52 |
| ▸ | CDC25B | P30305 | 8/20 | 0.52 |
| ▸ | SIRT2 | Q8IXJ6 | 3/20 | 0.51 |
| ▸ | CDC25A | P30304 | 1/20 | 0.50 |
| ▸ | CDC25C | P30307 | 1/20 | 0.50 |
| ▸ | NPC1 | O15118 | 1/20 | 0.49 |
| ▸ | GAA | P10253 | 1/20 | 0.49 |
| ▸ | GFER | P55789 | 1/20 | 0.49 |
| ▸ | MAPT | P10636 | 1/20 | 0.48 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL9409034 | 0.92 | ALDH1A1 (0.56) | AKR1C3AKR1C2AKR1C4AKR1C1SIRT2 | |
| SCHEMBL9409032 | 0.90 | SIRT2 (0.59) | AKR1C3AKR1C2AKR1C4AKR1C1AKR1B10 | |
| SCHEMBL9409059 | 0.89 | ALDH1A1 (0.58) | AKR1C3AKR1C2AKR1C4AKR1C1CDC25B | |
| SCHEMBL9409202 | 0.86 | MAPT (0.64) | AKR1C3AKR1C2SIRT2GAAMAPT | |
| SCHEMBL9409193 | 0.85 | CDC25B (0.60) | CDC25BCDC25ACDC25CNPC1MAPT | |
| SCHEMBL9409210 | 0.85 | SIRT2 (0.58) | AKR1C3AKR1C2SIRT2NPC1GAA | |
| SCHEMBL9409200 | 0.84 | AKR1C3 (0.52) | AKR1C3AKR1C2SIRT2MAPTALOX15 | |
| SCHEMBL9409062 | 0.84 | SIRT2 (0.47) | SIRT2MAPTALOX15ALDH1A1 | |
| SCHEMBL9409093 | 0.83 | LMNA (0.52) | SIRT2NPC1GAAMAPTALOX15 | |
| SCHEMBL9409049 | 0.83 | AKR1C3 (0.58) | AKR1C3AKR1C2SIRT2NPC1GAA |
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-0600832-A1 | Derivatives of diamino benzoic and diamino phthalic acid und their use as protein linase inhibitors | CIBA-GEIGY AG (CH) | 1994-06-08 | — | — | EP | disclosed |