Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.44 |
| ▸ | CYP3A5 | P20815 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | KMO | O15229 | 2/20 | 0.41 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | PPARG | P37231 | 1/20 | 0.39 |
| ▸ | PPARA | Q07869 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | CHEK2 | O96017 | 4/20 | 0.39 |
| ▸ | HTR2A | P28223 | 2/20 | 0.38 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.38 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.37 |
| ▸ | CA12 | O43570 | 1/20 | 0.37 |
| ▸ | CA1 | P00915 | 1/20 | 0.37 |
| ▸ | CA2 | P00918 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL27635688 | 0.78 | KDM4E (0.44) | KMOHSP90AA1KDM4EALDH1A1PPARG | |
| SCHEMBL23753577 | 0.73 | MEN1 (0.57) | CYP3A4CYP2D6CYP3A5CYP2C19KMO | |
| SCHEMBL28285422 | 0.70 | FFAR1 (0.42) | CYP3A4KMOHSP90AA1KDM4EALDH1A1 | |
| SCHEMBL9189704 | 0.69 | MCL1 (0.51) | CYP3A4CYP2D6CYP3A5CYP2C19KDM4E | |
| SCHEMBL10695957 | 0.69 | KDM4E (0.43) | CYP3A4CYP2D6CYP3A5CYP2C19KMO | |
| SCHEMBL8343410 | 0.69 | MCL1 (0.51) | CYP3A4CYP2D6CYP3A5CYP2C19KDM4E | |
| SCHEMBL7745278 | 0.69 | CA12 (0.40) | KDM4EALDH1A1LMNATSHRCA12 | |
| Hydrochloric Acid SCHEMBL30466486 | 0.68 | MCL1 (0.50) | CYP3A4CYP2D6CYP3A5CYP2C19KDM4E | |
| SCHEMBL27847863 | 0.68 | ACHE (0.40) | CYP3A4CYP2C19ALDH1A1LMNAKCNH2 | |
| SCHEMBL1587868 | 0.67 | KDM4E (0.47) | KMOHSP90AA1KDM4EALDH1A1PPARG |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0399856-B1 | Pteridin-4 (3H)-ones, processes for their preparation and medicaments containing them | LIPHA (FR) | 1995-08-09 | — | — | EP | disclosed |
| EP-0399856-A1 | Pteridin-4 (3H)-ones, processes for their preparation and medicaments containing them | LIPHA, LYONNAISE INDUSTRIELLE PHARMACEUTIQUE (FR) | 1990-11-28 | — | — | EP | disclosed |