Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 2/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.50 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.50 |
| ▸ | PYGB | P11216 | 6/20 | 0.47 |
| ▸ | HK2 | P52789 | 5/20 | 0.46 |
| ▸ | HK1 | P19367 | 4/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | CA12 | O43570 | 1/20 | 0.40 |
| ▸ | CA1 | P00915 | 1/20 | 0.40 |
| ▸ | CA2 | P00918 | 1/20 | 0.40 |
| ▸ | CA9 | Q16790 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | THRB | P10828 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL11415353 | 1.00 | LMNA (0.50) | LMNAKDM4ECYP2D6CYP2C19PYGB | |
| SCHEMBL11754898 | 0.87 | LMNA (0.37) | LMNAKDM4ECYP2D6CYP2C19PYGB | |
| SCHEMBL13382478 | 0.85 | LMNA (0.50) | LMNAKDM4ECYP2D6CYP2C19PYGB | |
| SCHEMBL11756125 | 0.82 | CA2 (0.49) | PYGBMAPK1CA1CA2CA9 | |
| SCHEMBL11758775 | 0.82 | CA2 (0.49) | PYGBMAPK1CA1CA2CA9 | |
| SCHEMBL11424984 | 0.82 | PYGB (0.65) | PYGBGAA | |
| SCHEMBL17082329 | 0.81 | PYGB (0.64) | LMNAKDM4ECYP2D6CYP2C19PYGB | |
| SCHEMBL12016499 | 0.81 | PYGB (0.64) | LMNAKDM4ECYP2D6CYP2C19PYGB | |
| SCHEMBL18778627 | 0.81 | PYGB (0.64) | LMNAKDM4ECYP2D6CYP2C19PYGB | |
| SCHEMBL19687603 | 0.81 | PYGB (0.64) | LMNAKDM4ECYP2D6CYP2C19PYGB |
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-4211866-A | ANTITUMOR AGENTS | NIPPON SHINYAKU CO., LTD. (JP) | 1980-07-08 | — | — | US | disclosed |