Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGB3 | P05106 | 1/20 | 0.45 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.45 |
| ▸ | GAA | P10253 | 3/20 | 0.45 |
| ▸ | LMNA | P02545 | 2/20 | 0.45 |
| ▸ | MAPT | P10636 | 2/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | HRH3 | Q9Y5N1 | 5/20 | 0.44 |
| ▸ | AOC3 | Q16853 | 2/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.41 |
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | SPHK1 | Q9NYA1 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.40 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL8635011 | 0.85 | ITGB3 (0.48) | ITGB3ITGA2BGAAHRH3AOC3 | |
| Hydrochloric Acid SCHEMBL8837973 | 0.83 | ITGB3 (0.47) | ITGB3ITGA2BGAAHRH3AOC3 | |
| SCHEMBL9023631 | 0.83 | ITGB3 (0.47) | ITGB3ITGA2BGAALMNAMAPT | |
| SCHEMBL10759049 | 0.80 | MAPT (0.45) | GAALMNAMAPTKDM4ETSHR | |
| SCHEMBL11858146 | 0.79 | ALDH1A1 (0.44) | GAALMNAMAPTTSHRCYP3A4 | |
| SCHEMBL7334455 | 0.78 | ITGB3 (0.51) | ITGB3ITGA2BGAALMNAMAPT | |
| SCHEMBL10759933 | 0.78 | ALDH1A1 (0.56) | GAALMNAMAPTTSHRALDH1A1 | |
| Hydrochloric Acid SCHEMBL8637477 | 0.77 | GAA (0.46) | ITGB3ITGA2BGAAMAPTKDM4E | |
| SCHEMBL8633587 | 0.77 | ITGB3 (0.45) | ITGB3ITGA2BGAAMAPTKDM4E | |
| SCHEMBL7958507 | 0.76 | HPGD (0.55) | GAALMNAMAPTKDM4EHRH3 |
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 |