Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 1/20 | 0.43 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.41 |
| ▸ | HRH3 | Q9Y5N1 | 3/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | ESR1 | P03372 | 1/20 | 0.37 |
| ▸ | THRA | P10827 | 1/20 | 0.37 |
| ▸ | THRB | P10828 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | DRD2 | P14416 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL9601499 | 0.93 | ACHE (0.41) | ACHEMAPK14HRH3CYP1A2CYP3A4 | |
| Maleic Acid SCHEMBL9865891 | 0.90 | ACHE (0.38) | ACHEMAPK14HRH3THRBMEN1 | |
| Fumaric Acid SCHEMBL9865899 | 0.90 | ACHE (0.38) | ACHEMAPK14HRH3THRBMEN1 | |
| SCHEMBL9601994 | 0.86 | ACHE (0.40) | ACHEHRH3DRD2 | |
| Water SCHEMBL9865858 | 0.85 | HRH3 (0.37) | HRH3DRD2 | |
| Water SCHEMBL9865856 | 0.85 | HRH3 (0.37) | HRH3DRD2 | |
| Fumaric Acid SCHEMBL9868348 | 0.82 | L3MBTL1 (0.37) | ACHEMAPK14HRH3THRBMEN1 | |
| Fumaric Acid SCHEMBL9601552 | 0.82 | L3MBTL1 (0.37) | ACHEMAPK14HRH3THRBMEN1 | |
| SCHEMBL9865917 | 0.81 | MAOA (0.34) | ACHEHRH3MEN1KMT2A | |
| SCHEMBL9867304 | 0.81 | MAOA (0.35) | ACHEHRH3MEN1KMT2A |
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-5045541-A | Immunodeficiency disorders | YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) | 1991-09-03 | — | — | US | disclosed |
| EP-0351435-A1 | FUSED PYRIDAZINE COMPOUNDS AND THEIR MEDICINAL USES | Yoshitomi Pharmaceutical Industries, Ltd. (JP) | 1990-01-24 | — | — | EP | disclosed |