Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | APP | P05067 | 7/20 | 0.39 |
| ▸ | PRF1 | P14222 | 1/20 | 0.36 |
| ▸ | CYP11B1 | P15538 | 2/20 | 0.36 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.33 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.33 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP2E1 | P05181 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | CYP4B1 | P13584 | 1/20 | 0.33 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.33 |
| ▸ | CYP3A5 | P20815 | 1/20 | 0.33 |
| ▸ | CYP2A7 | P20853 | 1/20 | 0.33 |
| ▸ | CYP3A7 | P24462 | 1/20 | 0.33 |
| ▸ | CYP2F1 | P24903 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL22238922 | 0.87 | APP (0.37) | APPPRF1CYP2C19CYP1A1CYP1A2 | |
| SCHEMBL22238956 | 0.86 | APP (0.39) | APPPRF1CYP11B1CYP11B2CYP2C19 | |
| SCHEMBL21537419 | 0.85 | APP (0.33) | APPPRF1CYP11B1CYP11B2HSD17B1 | |
| SCHEMBL21537527 | 0.83 | APP (0.39) | APPPRF1CYP11B1CYP11B2CYP2C19 | |
| SCHEMBL22238937 | 0.83 | CYP2C19 (0.41) | APPPRF1CYP2C19CYP1A1CYP1A2 | |
| SCHEMBL19682268 | 0.83 | APP (0.41) | APPPRF1CYP11B1CYP11B2CYP2C19 | |
| SCHEMBL21134114 | 0.80 | CYP11B1 (0.45) | APPCYP11B1CYP11B2CYP2C19PDK2 | |
| SCHEMBL18418558 | 0.78 | RARA (0.33) | CYP2C19CYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL22239082 | 0.78 | L3MBTL1 (0.34) | APPPRF1CYP11B1CYP11B2CYP2C19 | |
| SCHEMBL22022025 | 0.78 | APP (0.45) | APPCYP2C19CYP1A1CYP1A2CYP2E1 |
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 |
|---|---|---|---|---|---|---|---|
| US-20230053362-A1 | DICHROIC DYE COMPOSITION | MERCK PATENT GMBH (DE) | 2023-02-23 | — | — | US | disclosed |
| EP-3458549-B1 | LIQUID-CRYSTAL MATERIAL | MERCK PATENT GMBH (DE) | 2020-07-22 | — | — | EP | disclosed |