Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FASN | P49327 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.33 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.32 |
| ▸ | APP | P05067 | 2/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.30 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL18626210 | 0.89 | FASN (0.38) | FASNCYP3A4CYP2C9ESR2APP | |
| SCHEMBL14015550 | 0.89 | FASN (0.38) | FASNCYP3A4CYP2C9ESR2APP | |
| SCHEMBL22666561 | 0.83 | FASN (0.39) | FASNCYP3A4CYP2C9ESR2APP | |
| SCHEMBL22666481 | 0.81 | ESR2 (0.33) | ESR2 | |
| SCHEMBL22666394 | 0.80 | ESR2 (0.38) | ESR2 | |
| SCHEMBL18622097 | 0.78 | FASN (0.39) | FASNCYP3A4CYP2C9ESR2APP | |
| SCHEMBL23510880 | 0.78 | CYP3A4 (0.33) | CYP3A4CYP2C9APP | |
| SCHEMBL25056660 | 0.77 | CYP3A4 (0.33) | FASNCYP3A4CYP2C9APPCYP2D6 | |
| SCHEMBL22416048 | 0.77 | NAAA (0.34) | ESR2CYP2C19 | |
| SCHEMBL22666411 | 0.77 | APP (0.36) | CYP3A4CYP2C9ESR2APPCYP2D6 |
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-3543314-B1 | LIQUID-CRYSTALLINE MEDIUM | MERCK PATENT GMBH (DE) | 2020-09-09 | — | — | EP | disclosed |