Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | L3MBTL1 | Q9Y468 | 4/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | APP | P05067 | 2/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.31 |
| ▸ | MAOB | P27338 | 2/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 2/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.30 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | POLB | P06746 | 1/20 | 0.30 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.30 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.30 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.30 |
| ▸ | CYP11B2 | P19099 | 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 | |
|---|---|---|---|---|
| SCHEMBL22239082 | 0.92 | L3MBTL1 (0.34) | L3MBTL1ALDH1A1MAPTHTTAPP | |
| SCHEMBL19636762 | 0.91 | RARA (0.36) | ALDH1A1MAPTCYP2C19CYP1A2CYP2D6 | |
| SCHEMBL19682268 | 0.82 | APP (0.41) | L3MBTL1APPCYP2C19CYP1A2CYP2D6 | |
| SCHEMBL21537527 | 0.82 | APP (0.39) | L3MBTL1ALDH1A1MAPTAPPCYP2C19 | |
| SCHEMBL22238934 | 0.81 | CYP2C19 (0.35) | L3MBTL1ALDH1A1MAPTHTTAPP | |
| SCHEMBL19119878 | 0.81 | RARA (0.36) | MAPTCYP1A2CYP2D6 | |
| SCHEMBL22241055 | 0.81 | CYP2C19 (0.39) | L3MBTL1ALDH1A1MAPTHTTAPP | |
| SCHEMBL20900687 | 0.81 | RARA (0.37) | ALDH1A1MAPTCYP2C19CYP1A2CYP2D6 | |
| SCHEMBL21537529 | 0.80 | APP (0.34) | APPCYP2C19CYP1A2CYP2D6CYP2C9 | |
| SCHEMBL20647290 | 0.79 | RARB (0.40) | L3MBTL1MAPTMAPK1KDM4E |
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-3400271-B1 | LIQUID-CRYSTALLINE MIXTURES | MERCK PATENT GMBH (DE) | 2020-07-22 | — | — | EP | disclosed |