Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1A | P08908 | 8/20 | 0.48 |
| ▸ | SIGMAR1 | Q99720 | 4/20 | 0.47 |
| ▸ | HTR7 | P34969 | 1/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
| ▸ | PARP1 | P09874 | 1/20 | 0.42 |
| ▸ | DRD2 | P14416 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL7335487 | 0.91 | SIGMAR1 (0.47) | HTR1ASIGMAR1HTR7PARP1DRD2 | |
| SCHEMBL9735887 | 0.88 | PARP1 (0.45) | HTR1ASIGMAR1HTR7PARP1DRD2 | |
| SCHEMBL9372501 | 0.88 | SIGMAR1 (0.52) | HTR1ASIGMAR1PARP1DRD2 | |
| SCHEMBL7299309 | 0.87 | SIGMAR1 (0.49) | SIGMAR1PARP1KDM4EALDH1A1 | |
| SCHEMBL7297853 | 0.84 | SIGMAR1 (0.48) | HTR1ASIGMAR1HTR7RAB9ADRD2 | |
| SCHEMBL7304233 | 0.84 | SIGMAR1 (0.49) | HTR1ASIGMAR1HTR7ALDH1A1POLB | |
| SCHEMBL9371817 | 0.83 | HTR1A (0.56) | HTR1ASIGMAR1DRD2 | |
| Fumaric Acid SCHEMBL9375443 | 0.83 | SIGMAR1 (0.46) | HTR1ASIGMAR1HTR7PARP1KDM4E | |
| Maleic Acid SCHEMBL9375437 | 0.83 | SIGMAR1 (0.46) | HTR1ASIGMAR1HTR7PARP1KDM4E | |
| SCHEMBL7335467 | 0.77 | RAB9A (0.40) | NPC1RAB9AALDH1A1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5149817-A | Psychotropic agents | SHIONOGI & CO., LTD. (JP) | 1992-09-22 | — | — | US | disclosed |
| EP-0445701-A1 | Novel tetrahydropyridine derivatives | SHIONOGI SEIYAKU KABUSHIKI KAISHA trading under the name of SHIONOGI & CO. LTD. (JP) | 1991-09-11 | — | — | EP | disclosed |