Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.57 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.57 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.57 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.57 |
| ▸ | TBXA2R | P21731 | 5/20 | 0.51 |
| ▸ | MEN1 | O00255 | 1/20 | 0.51 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.51 |
| ▸ | TBXAS1 | P24557 | 14/20 | 0.49 |
| ▸ | PTGIS | Q16647 | 6/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL10337172 | 0.89 | TBXAS1 (0.56) | CYP1A2CYP3A4CYP2C9CYP2C19TBXA2R | |
| SCHEMBL10550029 | 0.89 | TBXAS1 (0.48) | CYP1A2CYP3A4CYP2C9CYP2C19TBXAS1 | |
| SCHEMBL10350317 | 0.86 | CYP1A2 (0.72) | CYP1A2CYP3A4CYP2C9CYP2C19TBXA2R | |
| SCHEMBL10558107 | 0.83 | TBXA2R (0.49) | CYP1A2CYP3A4CYP2C9CYP2C19TBXA2R | |
| SCHEMBL10337091 | 0.79 | TBXAS1 (0.54) | CYP1A2CYP3A4CYP2C9CYP2C19TBXAS1 | |
| SCHEMBL10550190 | 0.76 | TBXA2R (0.73) | CYP1A2CYP3A4CYP2C9CYP2C19TBXA2R | |
| SCHEMBL12675684 | 0.76 | CYP1A2 (0.89) | CYP1A2CYP3A4CYP2C9CYP2C19TBXA2R | |
| SCHEMBL10465091 | 0.76 | CYP1A2 (0.89) | CYP1A2CYP3A4CYP2C9CYP2C19TBXA2R | |
| SCHEMBL10401364 | 0.75 | TBXAS1 (0.70) | CYP1A2CYP3A4CYP2C9CYP2C19TBXA2R | |
| SCHEMBL10401287 | 0.74 | CYP1A2 (0.64) | CYP1A2CYP3A4CYP2C9CYP2C19TBXA2R |
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-4845120-A | THROMBOXANE ANTAGONISTS | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1989-07-04 | — | — | US | disclosed |
| EP-0246002-A2 | Alkenamide derivatives | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1987-11-19 | — | — | EP | disclosed |