Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 7/20 | 0.67 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.61 |
| ▸ | SLC22A6 | Q4U2R8 | 1/20 | 0.61 |
| ▸ | ENPP1 | P22413 | 1/20 | 0.55 |
| ▸ | ADORA2A | P29274 | 4/20 | 0.52 |
| ▸ | AHCY | P23526 | 3/20 | 0.52 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.50 |
| ▸ | CYP2D6 | P10635 | 6/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL8709179 | 0.99 | CYP3A4 (0.65) | CYP3A4FGFR1SLC22A6ENPP1ADORA2A | |
| SCHEMBL8709166 | 0.99 | CYP3A4 (0.65) | CYP3A4FGFR1SLC22A6ENPP1ADORA2A | |
| SCHEMBL8895953 | 0.90 | CYP3A4 (0.54) | CYP3A4FGFR1SLC22A6ENPP1ADORA2A | |
| SCHEMBL66563 | 0.84 | CYP3A4 (0.73) | CYP3A4FGFR1SLC22A6ADORA2AAHCY | |
| SCHEMBL385752 | 0.84 | CYP3A4 (0.73) | CYP3A4FGFR1SLC22A6ADORA2AAHCY | |
| SCHEMBL29437221 | 0.84 | CYP3A4 (0.73) | CYP3A4FGFR1SLC22A6ADORA2AAHCY | |
| SCHEMBL10670033 | 0.82 | FGFR1 (0.65) | CYP3A4FGFR1SLC22A6ENPP1ADORA2A | |
| Pyrophosphoric Acid SCHEMBL10602251 | 0.81 | CYP3A4 (0.55) | CYP3A4FGFR1SLC22A6ENPP1ADORA2A | |
| Tenofovir Anhydrous SCHEMBL39724 | 0.80 | CYP3A4 (1.00) | CYP3A4FGFR1SLC22A6CYP2D6 | |
| Tenofovir Anhydrous SCHEMBL2040329 | 0.80 | CYP3A4 (1.00) | CYP3A4FGFR1SLC22A6CYP2D6 |
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-0398231-B1 | Nucleoside analogs | ACAD OF SCIENCE CZECH REPUBLIC (CZ) | 1997-07-16 | — | — | EP | claimed |