Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCRTR1 | O43613 | 11/20 | 0.44 |
| ▸ | HCRTR2 | O43614 | 11/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | SLC6A7 | Q99884 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | PARP1 | P09874 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | HRH2 | P25021 | 1/20 | 0.40 |
| ▸ | HRH1 | P35367 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL6652566 | 0.99 | HCRTR1 (0.45) | HCRTR1HCRTR2ALDH1A1SLC6A7HPGD | |
| Hydrochloric Acid SCHEMBL6652387 | 0.98 | HCRTR1 (0.44) | HCRTR1HCRTR2ALDH1A1SLC6A7HPGD | |
| Hypochlorous Acid SCHEMBL6657831 | 0.90 | HRH2 (0.43) | HCRTR1HCRTR2ALDH1A1SLC6A7KDM4E | |
| Hypochlorous Acid SCHEMBL6650991 | 0.89 | HCRTR1 (0.48) | HCRTR1HCRTR2ALDH1A1SLC6A7HPGD | |
| Hypochlorous Acid SCHEMBL6653316 | 0.89 | MEN1 (0.41) | ALDH1A1SLC6A7HPGDKDM4EMEN1 | |
| Hypochlorous Acid SCHEMBL7713970 | 0.88 | HCRTR1 (0.46) | HCRTR1HCRTR2ALDH1A1SLC6A7HPGD | |
| SCHEMBL6651929 | 0.88 | HRH2 (0.44) | HCRTR1HCRTR2ALDH1A1SLC6A7KDM4E | |
| Hydrochloric Acid SCHEMBL6657823 | 0.88 | HRH2 (0.43) | HCRTR1HCRTR2ALDH1A1SLC6A7KDM4E | |
| SCHEMBL6651019 | 0.88 | MEN1 (0.41) | ALDH1A1SLC6A7HPGDKDM4EMEN1 | |
| SCHEMBL6649976 | 0.87 | HCRTR1 (0.46) | HCRTR1HCRTR2ALDH1A1SLC6A7HPGD |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1006110-B1 | DERIVATIVES OF ACYL-PIPERAZINIL-PYRIMIDINS, PREPARATION THEREOF AND APPLICATION AS MEDICAMENTS | ESTEVE LABOR DR (ES) | 2004-02-11 | — | — | EP | claimed |
| US-6372746-B1 | ANTICONVULSIVE AGENTS, SEDATIVES AND EATING DISORDERS | LABORATORIOS DEL DR. ESTEVE, S.A. (ES) | 2002-04-16 | — | — | US | claimed |
| EP-1006110-A1 | DERIVATIVES OF ACYL-PIPERAZINIL-PYRIMIDINS, PREPARATION THEREOF AND APPLICATION AS MEDICAMENTS | LABORATORIOS DEL DR. ESTEVE, S.A. (ES) | 2000-06-07 | — | — | EP | claimed |