Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIK3CA | P42336 | 5/20 | 0.37 |
| ▸ | AURKA | O14965 | 1/20 | 0.37 |
| ▸ | CDK1 | P06493 | 1/20 | 0.37 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.37 |
| ▸ | HRH4 | Q9H3N8 | 4/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.36 |
| ▸ | USP2 | O75604 | 3/20 | 0.36 |
| ▸ | CASP1 | P29466 | 3/20 | 0.36 |
| ▸ | CASP7 | P55210 | 3/20 | 0.36 |
| ▸ | EEF2K | O00418 | 3/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | EEF2 | P13639 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL9564504 | 0.86 | RXFP1 (0.42) | PIK3CAALDH1A1EEF2KMEN1KMT2A | |
| SCHEMBL9564461 | 0.83 | AURKA (0.37) | AURKACDK1AURKBHRH4ALDH1A1 | |
| SCHEMBL9564467 | 0.79 | KDM4E (0.41) | ALDH1A1HSD17B10MAPK1MEN1KMT2A | |
| Hydrochloric Acid SCHEMBL9564479 | 0.76 | SCN5A (0.34) | ALDH1A1CYP1A2HSD17B10USP2CASP1 | |
| SCHEMBL9805870 | 0.73 | CNR1 (0.47) | PIK3CAEEF2KEEF2CNR2 | |
| SCHEMBL9564472 | 0.68 | KDM4E (0.42) | AURKAAURKBALDH1A1CYP1A2HSD17B10 | |
| SCHEMBL7094750 | 0.68 | DPP4 (0.39) | HSD17B10KMT2A | |
| SCHEMBL9564474 | 0.68 | KDM4E (0.39) | ALDH1A1CYP1A2HSD17B10USP2CASP1 | |
| SCHEMBL6801320 | 0.67 | ALDH1A1 (0.40) | HRH4ALDH1A1CYP1A2HSD17B10USP2 | |
| SCHEMBL10877952 | 0.67 | ADH5 (0.38) | CYP1A2HSD17B10USP2MAPK1MEN1 |
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-0531958-A1 | 6-Aminoquinolones, their synthesis and their use as antibacterial agents | MEDIOLANUM FARMACEUTICI S.P.A. (IT) | 1993-03-17 | — | — | EP | disclosed |