Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | F10 | P00742 | 6/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.50 |
| ▸ | GAA | P10253 | 1/20 | 0.50 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.48 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.47 |
| ▸ | BDKRB1 | P46663 | 1/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.44 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | KLK7 | P49862 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL8637465 | 0.77 | CYP2C9 (0.45) | F10ALDH1A1HRH3CYP3A4CYP2D6 | |
| SCHEMBL8637208 | 0.77 | F10 (0.49) | F10HRH3 | |
| Hydrochloric Acid SCHEMBL11078727 | 0.75 | TPSAB1 (0.44) | F10ALDH1A1SMN1; SMN2KLK7 | |
| SCHEMBL7394932 | 0.75 | HRH3 (0.47) | F10ALDH1A1GAAHRH3LMNA | |
| SCHEMBL8636538 | 0.75 | F10 (0.44) | F10ALDH1A1GAA | |
| SCHEMBL6211789 | 0.74 | POLB (0.61) | F10ALDH1A1GAAHRH3CYP3A4 | |
| SCHEMBL9409461 | 0.73 | DRD2 (0.48) | F10GAALMNA | |
| SCHEMBL4711656 | 0.72 | ITGB3 (0.54) | — | |
| SCHEMBL7405501 | 0.72 | F10 (0.49) | F10ALDH1A1GAAHRH3LMNA | |
| Hydrochloric Acid SCHEMBL9023569 | 0.72 | HTR7 (0.48) | ALDH1A1HRH3CYP3A4CYP2D6CYP2C9 |
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 |