Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | LTA4H | P09960 | 1/20 | 0.31 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.30 |
| ▸ | SIGMAR1 | Q99720 | 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 | |
|---|---|---|---|---|
| SCHEMBL9047634 | 0.94 | DRD3 (0.35) | L3MBTL1HRH3SIGMAR1 | |
| Fumaric Acid SCHEMBL9050004 | 0.86 | HRH3 (0.37) | L3MBTL1CYP2D6MEN1KMT2ASMN1; SMN2 | |
| SCHEMBL9048189 | 0.79 | — | — | |
| SCHEMBL9098582 | 0.78 | TBXAS1 (0.34) | KMT2AALDH1A1 | |
| SCHEMBL9046288 | 0.78 | SMN1; SMN2 (0.41) | L3MBTL1MEN1KMT2ASMN1; SMN2ALDH1A1 | |
| Fumaric Acid SCHEMBL9048779 | 0.77 | HRH4 (0.37) | MEN1KMT2AALDH1A1HRH3SIGMAR1 | |
| SCHEMBL9047118 | 0.77 | — | — | |
| Hydrochloric Acid SCHEMBL9096054 | 0.76 | KDM4E (0.35) | MEN1KMT2ASMN1; SMN2ALDH1A1 | |
| SCHEMBL9048002 | 0.75 | HRH4 (0.35) | HRH3 | |
| SCHEMBL9045817 | 0.74 | — | — |
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-0749966-A1 | 5-HT 3 RECEPTOR AGONIST, NOVEL THIAZOLE DERIVATIVE, AND INTERMEDIATE THEREFOR | YAMANOUCHI PHARMACEUTICAL CO. LTD. (JP) | 1996-12-27 | — | — | EP | disclosed |