Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGB3 | P05106 | 4/20 | 0.42 |
| ▸ | ITGA2B | P08514 | 4/20 | 0.42 |
| ▸ | HRH3 | Q9Y5N1 | 6/20 | 0.41 |
| ▸ | SPHK1 | Q9NYA1 | 2/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | AOC3 | Q16853 | 2/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 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 | |
|---|---|---|---|---|
| SCHEMBL8634924 | 0.93 | ITGB3 (0.43) | ITGB3ITGA2BHRH3SPHK1MAPK1 | |
| Hydrochloric Acid SCHEMBL8837971 | 0.75 | HRH3 (0.44) | ITGB3ITGA2BHRH3SPHK1MAPK1 | |
| SCHEMBL8637100 | 0.72 | HRH3 (0.44) | ITGB3ITGA2BHRH3SPHK1CYP3A4 | |
| Hydrochloric Acid SCHEMBL8838012 | 0.70 | HRH3 (0.38) | ITGB3ITGA2BHRH3SPHK1CYP3A4 | |
| SCHEMBL8630661 | 0.70 | TSHR (0.48) | ITGB3ITGA2BHRH3MAPK1AOC3 | |
| SCHEMBL8634749 | 0.69 | HRH3 (0.48) | HRH3SPHK1ALDH1A1 | |
| SCHEMBL27442371 | 0.68 | DRD4 (0.44) | ITGB3ITGA2BHRH3SPHK1AOC3 | |
| SCHEMBL8635008 | 0.68 | ITGB3 (0.44) | ITGB3ITGA2BHRH3SPHK1CYP3A4 | |
| SCHEMBL8837993 | 0.68 | HRH3 (0.48) | ITGB3ITGA2BHRH3CYP3A4CYP2D6 | |
| SCHEMBL8634875 | 0.67 | SPHK1 (0.39) | ITGB3ITGA2BHRH3SPHK1MAPK1 |
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-5753659-A | ANTICOAGULANTS FOR BLOOD DISORDER, CARDIOVASCULAR DISORDER, THROMBOSIS, | ZENECA LIMITED (GB) | 1998-05-19 | — | — | US | disclosed |
| US-5750754-A | TERTIARY BUTYL 3-METHYL-4-SUBSTITUTED BUTYRATE; CHEMICAL INTERMEDIATES FOR ANTICAOGULANT DRUGS | ZENECA LIMITED (GB) | 1998-05-12 | — | — | US | disclosed |