Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.49 |
| ▸ | GSK3B | P49841 | 1/20 | 0.42 |
| ▸ | PDK2 | Q15119 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.40 |
| ▸ | KDM1A | O60341 | 6/20 | 0.40 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.40 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.40 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.39 |
| ▸ | DPP4 | P27487 | 1/20 | 0.39 |
| ▸ | FASN | P49327 | 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 | |
|---|---|---|---|---|
| SCHEMBL8644239 | 0.91 | SLC6A3 (0.48) | SLC6A3GSK3BPDK2ALDH1A1TRPA1 | |
| SCHEMBL8382436 | 0.84 | ITGB3 (0.47) | SLC6A3PDK2KDM1AHRH3 | |
| SCHEMBL8645368 | 0.81 | ITGB3 (0.45) | ALDH1A1SIGMAR1HRH3 | |
| SCHEMBL8642886 | 0.81 | ITGB3 (0.41) | ALDH1A1SIGMAR1HRH3 | |
| SCHEMBL8643891 | 0.80 | SIGMAR1 (0.45) | SLC6A3GSK3BPDK2ALDH1A1KDM1A | |
| SCHEMBL8647542 | 0.77 | MC4R (0.36) | ALDH1A1SIGMAR1HRH3 | |
| SCHEMBL8650351 | 0.76 | KMT2A (0.52) | GSK3BSIGMAR1HRH3 | |
| SCHEMBL8379768 | 0.75 | GSK3B (0.54) | SLC6A3GSK3BALDH1A1TRPA1 | |
| SCHEMBL8379771 | 0.75 | GSK3B (0.54) | SLC6A3GSK3BALDH1A1TRPA1 | |
| SCHEMBL8647636 | 0.73 | ITGB3 (0.38) | ALDH1A1EPHX2 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5726185-A | BINDING OF ADHESIVE PROTEINS TO BLOOD PLATELET AGGREGATION AND CELL TO CELL ADHESION | HOFFMANN-LA ROCHE INC. (US) | 1998-03-10 | — | — | US | disclosed |