Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AURKB | Q96GD4 | 2/20 | 0.52 |
| ▸ | AURKA | O14965 | 1/20 | 0.52 |
| ▸ | CASP6 | P55212 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.43 |
| ▸ | HPGD | P15428 | 2/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | CDC7 | O00311 | 1/20 | 0.43 |
| ▸ | EEF2K | O00418 | 1/20 | 0.43 |
| ▸ | PLK4 | O00444 | 1/20 | 0.43 |
| ▸ | DYRK3 | O43781 | 1/20 | 0.43 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.43 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.43 |
| ▸ | ROS1 | P08922 | 1/20 | 0.43 |
| ▸ | AKT2 | P31751 | 1/20 | 0.43 |
| ▸ | MATK | P42679 | 1/20 | 0.43 |
| ▸ | MAPKAPK2 | P49137 | 1/20 | 0.43 |
| ▸ | CLK2 | P49760 | 1/20 | 0.43 |
| ▸ | GSK3A | P49840 | 1/20 | 0.43 |
| ▸ | GSK3B | P49841 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL7894762 | 0.94 | AURKB (0.56) | AURKBAURKACASP6ALDH1A1KDM4E | |
| SCHEMBL10796013 | 0.87 | AURKB (0.48) | AURKBAURKACASP6ALDH1A1KDM4E | |
| SCHEMBL10721057 | 0.82 | CASP6 (0.50) | AURKBAURKACASP6ALDH1A1KDM4E | |
| SCHEMBL9723988 | 0.81 | CASP6 (0.48) | CASP6ALDH1A1KDM4EMAPTPRKD3 | |
| SCHEMBL6073527 | 0.80 | CASP6 (0.60) | CASP6ALDH1A1KDM4EHPGDMAPT | |
| SCHEMBL9151485 | 0.80 | HSP90AA1 (0.44) | CASP6ALDH1A1KDM4EHPGDMAPT | |
| SCHEMBL10504157 | 0.80 | AURKB (0.52) | AURKBAURKAALDH1A1HPGDMAPT | |
| SCHEMBL10821013 | 0.79 | CASP6 (0.46) | AURKBAURKACASP6ALDH1A1KDM4E | |
| SCHEMBL11433078 | 0.79 | AURKB (0.52) | AURKBAURKACASP6ALDH1A1KDM4E | |
| SCHEMBL11332104 | 0.79 | CASP6 (0.43) | AURKBAURKACASP6ALDH1A1KDM4E |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0260557-B1 | ASYMMETRIC 1:2 METAL COMPLEX DYESTUFS | BAYER AG (DE) | 1991-11-27 | — | — | EP | disclosed |
| EP-0260557-A2 | Asymmetric 1:2 metal complex dyestufs | BAYER AG (DE) | 1988-03-23 | — | — | EP | disclosed |
| EP-0066230-B1 | 1:2-ASYMMETRIC DYESTUFFS OF CHROMIUM | BAYER AG (DE) | 1986-03-05 | — | — | EP | disclosed |
| EP-0066230-A1 | 1:2-asymmetric dyestuffs of chromium | BAYER AG (DE) | 1982-12-08 | — | — | EP | disclosed |