Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.67 |
| ▸ | RAB9A | P51151 | 2/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.49 |
| ▸ | MAPT | P10636 | 3/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.48 |
| ▸ | NPC1 | O15118 | 2/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.47 |
| ▸ | GAA | P10253 | 3/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
| ▸ | HTT | P42858 | 1/20 | 0.47 |
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 SCHEMBL6655268 | 0.99 | ALDH1A1 (0.65) | ALDH1A1RAB9ASMN1; SMN2MAPTKDM4E | |
| Hypochlorous Acid SCHEMBL6655275 | 0.98 | ALDH1A1 (0.64) | ALDH1A1RAB9ASMN1; SMN2MAPTKDM4E | |
| SCHEMBL6650909 | 0.89 | ALDH1A1 (0.70) | ALDH1A1RAB9ASMN1; SMN2MAPTNPC1 | |
| Hydrochloric Acid SCHEMBL6652741 | 0.88 | ALDH1A1 (0.68) | ALDH1A1RAB9ASMN1; SMN2MAPTNPC1 | |
| Hypochlorous Acid SCHEMBL6652746 | 0.87 | ALDH1A1 (0.67) | ALDH1A1RAB9ASMN1; SMN2MAPTNPC1 | |
| SCHEMBL13149786 | 0.81 | ALDH1A1 (1.00) | ALDH1A1RAB9ASMN1; SMN2MAPTKDM4E | |
| SCHEMBL6651929 | 0.81 | HRH2 (0.44) | ALDH1A1KDM4ELMNA | |
| Hypochlorous Acid SCHEMBL6657831 | 0.80 | HRH2 (0.43) | ALDH1A1KDM4ELMNA | |
| Hydrochloric Acid SCHEMBL6657823 | 0.80 | HRH2 (0.43) | ALDH1A1KDM4ELMNA | |
| SCHEMBL6657385 | 0.80 | SCD (0.55) | ALDH1A1SMN1; SMN2KDM4EL3MBTL1LMNA |
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 |