Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KHK | P50053 | 4/20 | 0.44 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.44 |
| ▸ | DRD4 | P21917 | 2/20 | 0.43 |
| ▸ | HRH1 | P35367 | 2/20 | 0.43 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.43 |
| ▸ | CHKA | P35790 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | RORC | P51449 | 1/20 | 0.40 |
| ▸ | HRH2 | P25021 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL12261943 | 0.74 | DRD4 (0.77) | DRD4HRH1HRH3 | |
| SCHEMBL3440293 | 0.73 | HRH1 (0.52) | HRH1HRH3MAPTHRH2 | |
| SCHEMBL18590696 | 0.73 | CHKA (0.67) | KHKCHRNA7DRD4HRH1HRH3 | |
| SCHEMBL4712908 | 0.70 | CHRNA7 (0.66) | CHRNA7HRH3CHKAKDM4EGAA | |
| SCHEMBL28112415 | 0.69 | CHKA (0.80) | CHKAKDM4EGAAMAPT | |
| SCHEMBL786054 | 0.69 | ACHE (0.47) | — | |
| SCHEMBL785872 | 0.69 | ACHE (0.46) | HRH1HRH3CHKARORC | |
| SCHEMBL1669246 | 0.68 | DRD4 (0.77) | KHKDRD4KDM4E | |
| SCHEMBL14248010 | 0.67 | LMNA (0.73) | CHKAKDM4EMAPT | |
| SCHEMBL8251460 | 0.66 | POLB (0.56) | DRD4CHKAKDM4EMAPT |
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 |