Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AOC1 | P19801 | 1/20 | 0.40 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | RECQL | P46063 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | HTT | P42858 | 2/20 | 0.33 |
| ▸ | GAA | P10253 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | THRB | P10828 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | GFER | P55789 | 1/20 | 0.33 |
| ▸ | PLEC | Q15149 | 1/20 | 0.33 |
| ▸ | IDO1 | P14902 | 1/20 | 0.33 |
| ▸ | JAK2 | O60674 | 2/20 | 0.32 |
| ▸ | JAK1 | P23458 | 2/20 | 0.32 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.30 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.30 |
| ▸ | ADRA2C | P18825 | 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL6677482 | 0.99 | AOC1 (0.42) | AOC1AOC3CYP3A4TSHRRECQL | |
| SCHEMBL6676279 | 0.89 | AOC1 (0.36) | AOC1AOC3ALDH1A1HTTGAA | |
| Hydrochloric Acid SCHEMBL6678103 | 0.87 | AOC1 (0.38) | AOC1AOC3HTT | |
| SCHEMBL6674456 | 0.86 | IDO1 (0.38) | CYP3A4TSHRHTTGAAMAPT | |
| Hydrochloric Acid SCHEMBL6675350 | 0.85 | IDO1 (0.37) | TSHRHTTGAAMAPTHPGD | |
| SCHEMBL6677574 | 0.85 | TNIK (0.38) | TSHRALDH1A1HTTMAPT | |
| SCHEMBL6676315 | 0.82 | CYP1A2 (0.36) | CYP3A4TSHRRECQLALDH1A1GAA | |
| SCHEMBL6676056 | 0.82 | KDM4C (0.40) | CYP3A4ALDH1A1HTTGAAKDM4E | |
| SCHEMBL6678172 | 0.82 | ALDH1A1 (0.34) | CYP3A4ALDH1A1HTTGAAMAPT | |
| Hydrochloric Acid SCHEMBL6676291 | 0.81 | CYP1A2 (0.35) | AOC1AOC3CYP3A4TSHRRECQL |
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 |
|---|---|---|---|---|---|---|---|
| EP-0798292-B1 | ANILINE DERIVATIVES HAVING NITROGEN MONOXIDE SYNTHASE INHIBITORY ACTIVITY | CHUGAI SEIYAKUKABUSHIKI KAISHA (JP) | 2004-11-03 | — | — | EP | claimed |