Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 4/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.41 |
| ▸ | ACP3 | P15309 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 2/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.37 |
| ▸ | HPRT1 | P00492 | 1/20 | 0.36 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.33 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.33 |
| ▸ | THRB | P10828 | 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 | |
|---|---|---|---|---|
| SCHEMBL28256742 | 0.87 | CYP1A2 (0.44) | CYP2A6CYP1A2ACP3ALDH1A1HSD17B10 | |
| SCHEMBL18243792 | 0.78 | — | — | |
| SCHEMBL1538546 | 0.78 | CYP2A6 (0.54) | CYP2A6CYP1A2ACP3ALDH1A1HSD17B10 | |
| SCHEMBL18243961 | 0.77 | PAX8 (0.38) | CYP2A6CYP1A2ALDH1A1HSD17B10TSHR | |
| SCHEMBL18241938 | 0.76 | — | — | |
| SCHEMBL11844876 | 0.74 | CYP2A6 (0.44) | CYP2A6CYP1A2ACP3ALDH1A1HSD17B10 | |
| SCHEMBL17966497 | 0.74 | CYP2A6 (0.44) | CYP2A6CYP1A2ACP3ALDH1A1HSD17B10 | |
| SCHEMBL8376830 | 0.74 | ACP3 (0.45) | CYP2A6CYP1A2ACP3ALDH1A1HSD17B10 | |
| SCHEMBL16933751 | 0.74 | CYP2A6 (0.44) | CYP2A6CYP1A2ACP3ALDH1A1HSD17B10 | |
| SCHEMBL17966537 | 0.74 | CYP1A2 (0.44) | CYP2A6CYP1A2ACP3ALDH1A1HSD17B10 |
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 |
|---|---|---|---|---|---|---|---|
| CN-105764885-B | The production method of acid and free-radical generating agent and acid and free radical | 富士胶片和光纯药株式会社 | 2018-11-09 | — | — | CN | disclosed |