Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.47 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.47 |
| ▸ | ACHE | P22303 | 7/20 | 0.42 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.37 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.37 |
| ▸ | ATM | Q13315 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | TERT | O14746 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL2773903 | 0.79 | CYP2A6 (0.48) | CYP1A2CYP2A6ACHEATMMAPT | |
| Iodide SCHEMBL3905319 | 0.78 | CYP2A6 (0.47) | CYP1A2CYP2A6ACHEATMMAPT | |
| SCHEMBL17141397 | 0.78 | ATM (0.61) | CYP1A2CYP2A6ATMMAPTMEN1 | |
| SCHEMBL278568 | 0.77 | ATM (0.56) | ACHEATMMAPTMEN1RAB9A | |
| SCHEMBL29464772 | 0.77 | ATM (0.56) | ACHEATMMAPTMEN1RAB9A | |
| Hydrochloric Acid SCHEMBL10713131 | 0.76 | ACHE (0.50) | CYP1A2ACHEATMMAPTMEN1 | |
| SCHEMBL9990610 | 0.76 | ALDH1A1 (0.50) | CYP1A2CYP2A6ACHETERT | |
| Iodide SCHEMBL11862696 | 0.75 | ATM (0.54) | ACHEATMMAPTMEN1RAB9A | |
| Bromide SCHEMBL11593076 | 0.75 | ATM (0.54) | ACHEATMMAPTMEN1RAB9A | |
| Iodide SCHEMBL30211080 | 0.75 | ATM (0.54) | ACHEATMMAPTMEN1RAB9A |
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-108912047-A | The synthetic method of acridone derivatives | 广州中医药大学(广州中医药研究院) | 2018-11-30 | — | — | CN | disclosed |