Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 10/20 | 0.52 |
| ▸ | LTA4H | P09960 | 2/20 | 0.52 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.51 |
| ▸ | PSMB1 | P20618 | 5/20 | 0.47 |
| ▸ | PSMB5 | P28074 | 4/20 | 0.47 |
| ▸ | PSMB2 | P49721 | 2/20 | 0.47 |
| ▸ | HTR1A | P08908 | 1/20 | 0.45 |
| ▸ | HTR7 | P34969 | 1/20 | 0.45 |
| ▸ | ESR1 | P03372 | 1/20 | 0.45 |
| ▸ | HTT | P42858 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL7402237 | 0.88 | ESR1 (0.48) | HRH3LTA4HKCNH2HTR1AHTR7 | |
| SCHEMBL7397850 | 0.87 | EPHX2 (0.47) | HRH3KDM4E | |
| Hydrochloric Acid SCHEMBL7488066 | 0.84 | ITGB3 (0.59) | ESR1 | |
| SCHEMBL7399207 | 0.81 | ITGB3 (0.55) | — | |
| SCHEMBL8458587 | 0.81 | SLC1A3 (0.47) | KDM4E | |
| SCHEMBL7487574 | 0.80 | ITGB3 (0.48) | — | |
| SCHEMBL7398725 | 0.80 | ITGB3 (0.46) | HRH3LTA4HKCNH2KDM4EHTR1A | |
| SCHEMBL7399762 | 0.80 | ITGB3 (0.50) | — | |
| SCHEMBL7397774 | 0.80 | ITGB3 (0.44) | — | |
| SCHEMBL7398498 | 0.80 | TBXAS1 (0.53) | KDM4EHTT |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5648368-A | ANTICOAGULANTS | MERCK & CO., INC. (US) | 1997-07-15 | — | — | US | disclosed |
| EP-0673247-A4 | FIBRINOGEN RECEPTOR ANTAGONISTS. | MERCK & CO INC (US) | 1996-05-01 | — | — | EP | disclosed |
| EP-0673247-A1 | FIBRINOGEN RECEPTOR ANTAGONISTS | MERCK & CO. INC. (US) | 1995-09-27 | — | — | EP | disclosed |
| WO-1994012181-A1 | FIBRINOGEN RECEPTOR ANTAGONISTS | MERCK & CO., INC. (US) | 1994-06-09 | — | — | WO | disclosed |