Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 2/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.38 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.38 |
| ▸ | NR4A3 | Q92570 | 1/20 | 0.38 |
| ▸ | CNR2 | P34972 | 3/20 | 0.38 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | RORC | P51449 | 1/20 | 0.37 |
| ▸ | RORB | Q92753 | 1/20 | 0.37 |
| ▸ | CNR1 | P21554 | 2/20 | 0.36 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.35 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL9515898 | 0.73 | ALDH1A1 (0.48) | CYP1A2ALDH1A1KDM4EKMT2AMAPT | |
| SCHEMBL3415394 | 0.70 | ABCG2 (0.37) | CYP2A6CYP1A2ALDH1A1CNR2ABCG2 | |
| Acetone SCHEMBL28077026 | 0.69 | CYP2A6 (0.74) | CYP2A6CYP1A2ALDH1A1NR4A1NR4A2 | |
| SCHEMBL11897801 | 0.68 | ALDH1A1 (0.47) | ALDH1A1CNR1GAATSHR | |
| SCHEMBL10529615 | 0.68 | MEN1 (0.45) | CYP1A2ALDH1A1MEN1KMT2ALMNA | |
| SCHEMBL9120992 | 0.68 | ALDH1A1 (0.39) | ALDH1A1KDM4EMEN1KMT2ALMNA | |
| SCHEMBL28181202 | 0.67 | KMT2A (0.56) | CYP2A6CYP1A2ALDH1A1TDP1KDM4E | |
| SCHEMBL11751093 | 0.67 | NPC1 (0.63) | CYP1A2ALDH1A1KDM4EMEN1KMT2A | |
| SCHEMBL517685 | 0.66 | ALDH1A1 (0.53) | CYP2A6CYP1A2ALDH1A1TDP1NR4A1 | |
| SCHEMBL29351228 | 0.66 | CYP2A6 (1.00) | CYP2A6CYP1A2ALDH1A1TDP1NR4A1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2280032-B1 | PHOTOPOLYMERIZABLE COMPOSITIONS | TOKUYAMA DENTAL CORP (JP) | 2015-01-07 | — | — | EP | disclosed |
| EP-2280032-A1 | PHOTOPOLYMERIZABLE COMPOSITIONS | Tokuyama Dental Corporation (JP) | 2011-02-02 | — | — | EP | disclosed |