Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | PPARD | Q03181 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 2/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.30 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.30 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.30 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.30 |
| ▸ | TDP1 | Q9NUW8 | 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 | |
|---|---|---|---|---|
| SCHEMBL10717181 | 0.77 | TSHR (0.36) | PPARDTSHR | |
| SCHEMBL9744853 | 0.77 | GAA (0.33) | MAPTTSHRCYP2D6CYP2C9CYP2C19 | |
| SCHEMBL9744920 | 0.76 | CYP2D6 (0.43) | PPARDTSHRCYP2D6CYP2C9CYP2C19 | |
| SCHEMBL9745133 | 0.73 | CYP2D6 (0.32) | PPARDTSHRCYP2D6CYP2C9CYP2C19 | |
| SCHEMBL10913361 | 0.72 | MGAM (0.39) | TSHRCYP2D6CYP2C9CYP2C19ALDH1A1 | |
| SCHEMBL9792736 | 0.72 | MGAM (0.39) | TSHRCYP2D6CYP2C9CYP2C19ALDH1A1 | |
| SCHEMBL10998341 | 0.71 | MGAM (0.38) | TSHRCYP2D6CYP2C9CYP2C19ALDH1A1 | |
| SCHEMBL12226250 | 0.70 | L3MBTL1 (0.38) | PPARDTSHRALDH1A1CYP3A4ALOX15 | |
| SCHEMBL9840702 | 0.69 | — | — | |
| SCHEMBL687973 | 0.68 | MAPT (0.47) | MAPTHTTPPARDTSHRALDH1A1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5175344-A | Anticonvulsants, anxiolytic agents | CIBA-GEIGY CORPORATION (US) | 1992-12-29 | — | — | US | disclosed |
| EP-0233154-B1 | UNSATURATED AMINO-ACIDS | CIBA-GEIGY AG (CH) | 1991-12-18 | — | — | EP | disclosed |
| US-5051413-A | For treatment of ischemia, antispasmodic agents, anticonvulsants and anxiety or manic conditions | CIBA-GEIGY CORPORATION (US) | 1991-09-24 | — | — | US | disclosed |
| EP-0233154-A2 | Unsaturated amino-acids | CIBA-GEIGY AG (CH) | 1987-08-19 | — | — | EP | disclosed |