Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGB3 | P05106 | 16/20 | 0.46 |
| ▸ | ITGA2B | P08514 | 16/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL7284083 | 1.00 | ITGB3 (0.46) | ITGB3ITGA2BKMT2ACYP2C19SMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL7287340 | 0.99 | ITGB3 (0.46) | ITGB3ITGA2BKMT2ACYP2C19SMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL7287357 | 0.99 | ITGB3 (0.46) | ITGB3ITGA2BKMT2ACYP2C19SMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL7288609 | 0.91 | ITGB3 (0.46) | ITGB3ITGA2BKMT2ACYP2C19SMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL7288594 | 0.91 | ITGB3 (0.46) | ITGB3ITGA2BKMT2ACYP2C19SMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL7277701 | 0.87 | ITGB3 (0.47) | ITGB3ITGA2BKMT2A | |
| Hydrochloric Acid SCHEMBL7277705 | 0.79 | CYP1A2 (0.36) | CYP2C19 | |
| SCHEMBL7285696 | 0.75 | GLA (0.52) | KMT2ACYP2C19SMN1; SMN2 | |
| SCHEMBL7277834 | 0.75 | PLA2G10 (0.56) | ITGB3ITGA2B | |
| SCHEMBL7277825 | 0.75 | PLA2G10 (0.56) | ITGB3ITGA2B |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0529858-B1 | 2-Piperazinone compounds, their production and use | TAKEDA CHEMICAL INDUSTRIES LTD (JP) | 1997-10-15 | — | — | EP | disclosed |
| US-5294713-A | Inhibiting cell adhesion | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1994-03-15 | — | — | US | disclosed |
| EP-0529858-A1 | 2-Piperazinone compounds, their production and use | Takeda Chemical Industries, Ltd. (JP) | 1993-03-03 | — | — | EP | disclosed |