Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 7/20 | 0.40 |
| ▸ | CYP2A6 | P11509 | 5/20 | 0.40 |
| ▸ | KIF11 | P52732 | 1/20 | 0.38 |
| ▸ | MAOA | P21397 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | ACHE | P22303 | 2/20 | 0.33 |
| ▸ | HPGD | P15428 | 2/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.33 |
| ▸ | THRB | P10828 | 1/20 | 0.33 |
| ▸ | MLKL | Q8NB16 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.32 |
| ▸ | FYN | P06241 | 1/20 | 0.32 |
| ▸ | AHR | P35869 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL8840866 | 0.77 | CYP1A2 (0.50) | CYP1A2CYP2A6KIF11MAOAMEN1 | |
| SCHEMBL27832989 | 0.77 | CYP1A2 (0.50) | CYP1A2CYP2A6KIF11MAOAMEN1 | |
| SCHEMBL18462923 | 0.76 | CYP1A2 (0.35) | CYP1A2CYP2A6KIF11ALDH1A1HPGD | |
| SCHEMBL31238980 | 0.75 | CYP1A2 (0.48) | CYP1A2CYP2A6KIF11MAOAMEN1 | |
| SCHEMBL28488893 | 0.75 | CYP1A2 (0.48) | CYP1A2CYP2A6KIF11MAOAMEN1 | |
| SCHEMBL18462345 | 0.75 | LDHA (0.42) | MEN1KMT2ANPC1POLBALDH1A1 | |
| SCHEMBL29511317 | 0.74 | ALDH1A1 (0.42) | CYP1A2CYP2A6KIF11MEN1KMT2A | |
| SCHEMBL23156698 | 0.74 | ALDH1A1 (0.44) | CYP1A2CYP2A6KIF11ALDH1A1HPGD | |
| SCHEMBL17180585 | 0.73 | KIF11 (0.54) | CYP1A2CYP2A6KIF11MAOAMEN1 | |
| SCHEMBL8840916 | 0.73 | KIF11 (0.54) | CYP1A2CYP2A6KIF11MAOAMEN1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2024128186-A1 | LIQUID CRYSTAL COMPOSITION, LIQUID CRYSTAL CURED LAYER, OPTICAL FILM, POLARIZING PLATE, AND IMAGE DISPLAY DEVICE | 富士フイルム株式会社 | 2024-06-20 | — | — | WO | disclosed |