Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AOC3 | Q16853 | 4/20 | 0.36 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.33 |
| ▸ | PNMT | P11086 | 1/20 | 0.32 |
| ▸ | CSNK2A1 | P68400 | 3/20 | 0.32 |
| ▸ | AOC1 | P19801 | 3/20 | 0.32 |
| ▸ | GAA | P10253 | 2/20 | 0.32 |
| ▸ | MAOA | P21397 | 1/20 | 0.32 |
| ▸ | PKM | P14618 | 1/20 | 0.32 |
| ▸ | PSIP1 | O75475 | 1/20 | 0.31 |
| ▸ | CSNK2A2 | P19784 | 1/20 | 0.30 |
| ▸ | CSNK2B | P67870 | 1/20 | 0.30 |
| ▸ | CSNK2A3 | Q8NEV1 | 1/20 | 0.30 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.30 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | GLA | P06280 | 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 | |
|---|---|---|---|---|
| SCHEMBL28000085 | 0.86 | AOC3 (0.36) | AOC3SLC6A4PNMTCSNK2A1AOC1 | |
| SCHEMBL14043172 | 0.75 | HRH3 (0.39) | AOC3PNMTCSNK2A1AOC1GAA | |
| SCHEMBL27993131 | 0.73 | AOC3 (0.39) | AOC3SLC6A4PNMTCSNK2A1MAOA | |
| SCHEMBL17052892 | 0.72 | ESR1 (0.40) | AOC3PNMTCSNK2A1AOC1HRH3 | |
| Hydrochloric Acid SCHEMBL27828043 | 0.71 | AOC3 (0.42) | AOC3SLC6A4PNMTCSNK2A1GAA | |
| SCHEMBL14383870 | 0.70 | ADRA2A (0.46) | GAAPKMKDM4EALDH1A1 | |
| SCHEMBL14043275 | 0.68 | LOXL2 (0.39) | AOC3AOC1GAAPKMHRH3 | |
| SCHEMBL8258347 | 0.68 | AOC1 (0.36) | AOC3PNMTCSNK2A1AOC1HRH3 | |
| SCHEMBL14899803 | 0.67 | ADRA2A (0.42) | GAAKDM4EALDH1A1GLA | |
| SCHEMBL27688493 | 0.67 | PARP1 (0.43) | AOC3PNMTCSNK2A1AOC1HRH3 |
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-105829285-A | Quinazolinone and isoquinolinone derivatives | 中外制药株式会社 | 2016-08-03 | — | — | CN | disclosed |