Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | P2RX7 | Q99572 | 8/20 | 0.43 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.42 |
| ▸ | CTSS | P25774 | 5/20 | 0.40 |
| ▸ | CTSK | P43235 | 5/20 | 0.40 |
| ▸ | CTSL | P07711 | 4/20 | 0.40 |
| ▸ | ITGB3 | P05106 | 2/20 | 0.40 |
| ▸ | ITGA2B | P08514 | 2/20 | 0.40 |
| ▸ | CTSB | P07858 | 4/20 | 0.40 |
| ▸ | F2 | P00734 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL7308737 | 0.90 | P2RX7 (0.47) | P2RX7HDAC8CTSSCTSKCTSL | |
| SCHEMBL7298331 | 0.88 | ITGB3 (0.46) | P2RX7HDAC8CTSSCTSKCTSL | |
| SCHEMBL7371888 | 0.88 | P2RX7 (0.48) | P2RX7HDAC8CTSKCTSL | |
| SCHEMBL7371887 | 0.88 | P2RX7 (0.48) | P2RX7HDAC8CTSKCTSL | |
| SCHEMBL7371886 | 0.88 | P2RX7 (0.48) | P2RX7HDAC8CTSKCTSL | |
| SCHEMBL7301305 | 0.86 | P2RX7 (0.43) | P2RX7HDAC8CTSSCTSKCTSL | |
| SCHEMBL7297146 | 0.83 | P2RX7 (0.49) | P2RX7CTSKCTSLITGB3ITGA2B | |
| Hydrochloric Acid SCHEMBL7306250 | 0.83 | ITGB3 (0.50) | ITGB3ITGA2B | |
| Hydrochloric Acid SCHEMBL7308781 | 0.83 | ITGB3 (0.52) | ITGB3ITGA2BKMT2A | |
| SCHEMBL7307823 | 0.82 | P2RX7 (0.46) | P2RX7CTSSCTSKCTSLCTSB |
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 |
|---|---|---|---|---|---|---|---|
| EP-0643072-B1 | 2-Piperazinone compounds and their use | TAKEDA CHEMICAL INDUSTRIES LTD (JP) | 1999-02-24 | — | — | EP | disclosed |
| EP-0643072-A1 | 2-Piperazinone compounds and their use | Takeda Chemical Industries, Ltd. (JP) | 1995-03-15 | — | — | EP | disclosed |