Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TBXAS1 | P24557 | 19/20 | 0.68 |
| ▸ | PTGIS | Q16647 | 14/20 | 0.68 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.51 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.51 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.51 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL10350315 | 0.90 | TBXAS1 (0.61) | TBXAS1PTGISCYP1A2CYP3A4CYP2C9 | |
| SCHEMBL10401364 | 0.89 | TBXAS1 (0.70) | TBXAS1PTGISCYP1A2CYP3A4CYP2C9 | |
| SCHEMBL10337091 | 0.89 | TBXAS1 (0.54) | TBXAS1PTGISCYP1A2CYP3A4CYP2C9 | |
| SCHEMBL10401497 | 0.89 | TBXAS1 (0.61) | TBXAS1PTGISCYP1A2CYP3A4CYP2C9 | |
| SCHEMBL10465109 | 0.87 | CYP1A2 (0.67) | TBXAS1PTGISCYP1A2CYP3A4CYP2C9 | |
| SCHEMBL10350341 | 0.82 | TBXAS1 (0.53) | TBXAS1PTGISCYP1A2CYP3A4CYP2C9 | |
| SCHEMBL10401720 | 0.82 | TBXAS1 (0.51) | TBXAS1PTGISCYP1A2CYP3A4CYP2C9 | |
| SCHEMBL9717913 | 0.82 | CYP1A2 (0.76) | TBXAS1PTGISCYP1A2CYP3A4CYP2C9 | |
| SCHEMBL10471087 | 0.81 | TBXAS1 (0.77) | TBXAS1PTGIS | |
| SCHEMBL9717936 | 0.81 | CYP1A2 (0.72) | TBXAS1PTGISCYP1A2CYP3A4CYP2C9 |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0223518-B1 | AMIDE DERIVATIVES | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1990-09-26 | — | — | EP | disclosed |
| US-4925869-A | REACTIVATING ENZYME ACETYLCHOLINESTERASE INHIBITED BY LETHAL DOSE OF SOMAN | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1990-05-15 | — | — | US | disclosed |
| US-4921979-A | THROMBOXANE A2 ANTAGONISTS | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1990-05-01 | — | — | US | disclosed |
| US-4806563-A | THROMBOXANE A2 ANTAGONIST | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1989-02-21 | — | — | US | disclosed |
| US-4775684-A | 1,3-dioxane ethers | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1988-10-04 | — | — | US | disclosed |
| EP-0201351-A2 | 1,3-Dioxane ethers | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1986-11-12 | — | — | EP | disclosed |