Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 4/20 | 0.43 |
| ▸ | LMNA | P02545 | 3/20 | 0.43 |
| ▸ | TP53 | P04637 | 3/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.41 |
| ▸ | NLRP3 | Q96P20 | 2/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | STAT3 | P40763 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 3/20 | 0.40 |
| ▸ | RAB9A | P51151 | 3/20 | 0.40 |
| ▸ | NPC1 | O15118 | 2/20 | 0.40 |
| ▸ | HTT | P42858 | 2/20 | 0.40 |
| ▸ | XBP1 | P17861 | 1/20 | 0.40 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.40 |
| ▸ | PTGS2 | P35354 | 3/20 | 0.39 |
| ▸ | PKM | P14618 | 2/20 | 0.37 |
| ▸ | RECQL | P46063 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | NFKB1 | P19838 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL23106842 | 1.00 | CYP3A4 (0.43) | CYP3A4LMNATP53CYP2D6NLRP3 | |
| SCHEMBL29380255 | 1.00 | CYP3A4 (0.43) | CYP3A4LMNATP53CYP2D6NLRP3 | |
| SCHEMBL12620339 | 0.80 | MAPT (0.43) | CYP3A4LMNATP53CYP2D6NLRP3 | |
| SCHEMBL24246322 | 0.75 | MAPT (0.47) | CYP3A4LMNATP53CYP2D6NLRP3 | |
| SCHEMBL14947797 | 0.75 | MAPT (0.47) | CYP3A4LMNATP53CYP2D6NLRP3 | |
| SCHEMBL29379738 | 0.75 | MAPT (0.47) | CYP3A4LMNATP53CYP2D6NLRP3 | |
| SCHEMBL29383396 | 0.75 | MAPT (0.47) | CYP3A4LMNATP53CYP2D6NLRP3 | |
| SCHEMBL23107237 | 0.75 | MAPT (0.47) | CYP3A4LMNATP53CYP2D6NLRP3 | |
| SCHEMBL23106837 | 0.74 | CYP19A1 (0.33) | — | |
| SCHEMBL23106925 | 0.74 | CYP19A1 (0.33) | — |
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-3634954-B1 | METHOD OF PRODUCING EPD AND ANALOGUES THEREOF | VAN HAAFTEN CAROLINE (NL) | 2022-02-09 | — | — | EP | disclosed |