Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 1/20 | 0.45 |
| ▸ | SRC | P12931 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | PPARA | Q07869 | 5/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | PPARG | P37231 | 2/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL10937313 | 1.00 | CYP2D6 (0.45) | CYP2D6SRCALDH1A1CYP3A4LMNA | |
| SCHEMBL11201973 | 1.00 | CYP2D6 (0.45) | CYP2D6SRCALDH1A1CYP3A4LMNA | |
| SCHEMBL641563 | 0.85 | ALDH1A1 (0.42) | CYP2D6SRCALDH1A1CYP3A4LMNA | |
| SCHEMBL641564 | 0.85 | ALDH1A1 (0.42) | CYP2D6SRCALDH1A1CYP3A4LMNA | |
| SCHEMBL6870170 | 0.83 | ALDH1A1 (0.62) | ALDH1A1CYP3A4LMNAKMT2A | |
| SCHEMBL3232420 | 0.82 | ATM (0.42) | CYP2D6SRCALDH1A1CYP3A4LMNA | |
| SCHEMBL8405171 | 0.82 | ATM (0.42) | CYP2D6SRCALDH1A1CYP3A4LMNA | |
| SCHEMBL7567010 | 0.82 | ATM (0.42) | CYP2D6SRCALDH1A1CYP3A4LMNA | |
| SCHEMBL103235 | 0.77 | ALDH1A1 (0.54) | CYP2D6SRCALDH1A1CYP3A4LMNA | |
| SCHEMBL155984 | 0.77 | ALDH1A1 (0.54) | CYP2D6SRCALDH1A1CYP3A4LMNA |
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-0097039-A1 | 5-(E-2-halovinyl)-2'-deoxyuridine derivatives, processes for their preparation, pharmaceutical compositions containing them, and their use in treating viral infections | BEECHAM GROUP PLC (GB) | 1983-12-28 | — | — | EP | disclosed |