Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DPP8 | Q6V1X1 | 7/20 | 0.47 |
| ▸ | DPP7 | Q9UHL4 | 7/20 | 0.47 |
| ▸ | DPP4 | P27487 | 5/20 | 0.47 |
| ▸ | ITGB3 | P05106 | 11/20 | 0.44 |
| ▸ | ITGA2B | P08514 | 11/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| Trifluoroacetic Acid SCHEMBL7364289 | 1.00 | DPP8 (0.47) | DPP8DPP7DPP4ITGB3ITGA2B | |
| Trifluoroacetic Acid SCHEMBL7365694 | 1.00 | DPP8 (0.47) | DPP8DPP7DPP4ITGB3ITGA2B | |
| SCHEMBL7438854 | 0.90 | DPP8 (0.42) | DPP8DPP7DPP4ITGB3ITGA2B | |
| SCHEMBL7935145 | 0.87 | ITGB3 (0.46) | ITGB3ITGA2BCYP3A4CYP2D6CYP2C9 | |
| SCHEMBL7370702 | 0.87 | ITGB3 (0.46) | ITGB3ITGA2BCYP3A4CYP2D6CYP2C9 | |
| SCHEMBL7370709 | 0.87 | ITGB3 (0.46) | ITGB3ITGA2BCYP3A4CYP2D6CYP2C9 | |
| Trifluoroacetic Acid SCHEMBL7924758 | 0.86 | ITGB3 (0.40) | DPP8DPP7DPP4ITGB3ITGA2B | |
| Trifluoroacetic Acid SCHEMBL7369430 | 0.86 | ITGB3 (0.40) | DPP8DPP7DPP4ITGB3ITGA2B | |
| SCHEMBL7444700 | 0.85 | ITGB3 (0.45) | ITGB3ITGA2BCYP3A4CYP2D6CYP2C9 | |
| Trifluoroacetic Acid SCHEMBL7924786 | 0.85 | ALDH1A1 (0.40) | DPP8DPP7DPP4ITGB3ITGA2B |
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-6242600-B1 | ANTIISCHEMIC AGENTS, ANTICOAGULANTS | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 2001-06-05 | — | — | US | claimed |
| US-6242600-B1 | ANTIISCHEMIC AGENTS, ANTICOAGULANTS | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 2001-06-05 | — | — | US | disclosed |