Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCRTR1 | O43613 | 10/20 | 0.45 |
| ▸ | HCRTR2 | O43614 | 10/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.45 |
| ▸ | MAPT | P10636 | 2/20 | 0.45 |
| ▸ | LMNA | P02545 | 1/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.45 |
| ▸ | ACHE | P22303 | 2/20 | 0.43 |
| ▸ | CXCR3 | P49682 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | PANK3 | Q9H999 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | HTR1A | P08908 | 1/20 | 0.41 |
| ▸ | TSPO | P30536 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL6655399 | 0.80 | GFER (0.61) | HCRTR1HCRTR2KDM4EHSD17B10MAPT | |
| Hydrochloric Acid SCHEMBL6653320 | 0.79 | GFER (0.60) | HCRTR1HCRTR2KDM4EHSD17B10MAPT | |
| Hypochlorous Acid SCHEMBL6653323 | 0.78 | GFER (0.59) | HCRTR1HCRTR2KDM4EHSD17B10MAPT | |
| Hydrochloric Acid SCHEMBL8151820 | 0.74 | OPRM1 (0.49) | KDM4EMAPTLMNATSHRKMT2A | |
| SCHEMBL6655479 | 0.74 | ALDH1A1 (0.74) | HCRTR1HCRTR2MAPTLMNAALDH1A1 | |
| Hydrochloric Acid SCHEMBL6654568 | 0.73 | ALDH1A1 (0.72) | HCRTR1HCRTR2MAPTLMNAALDH1A1 | |
| Hypochlorous Acid SCHEMBL6654575 | 0.73 | ALDH1A1 (0.72) | HCRTR1HCRTR2MAPTLMNAALDH1A1 | |
| SCHEMBL6674771 | 0.73 | L3MBTL1 (0.59) | HCRTR1HCRTR2KDM4EHSD17B10TSHR | |
| SCHEMBL6651379 | 0.73 | ACHE (0.53) | HCRTR1HCRTR2ACHEMEN1KMT2A | |
| SCHEMBL6653680 | 0.73 | HCRTR1 (0.40) | HCRTR1HCRTR2MAPTHTR1ATSPO |
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 |