Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGB3 | P05106 | 1/20 | 0.46 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.46 |
| ▸ | F2R | P25116 | 1/20 | 0.46 |
| ▸ | GNAI3 | P08754 | 1/20 | 0.42 |
| ▸ | GNAO1 | P09471 | 1/20 | 0.42 |
| ▸ | GNAI1 | P63096 | 1/20 | 0.42 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.41 |
| ▸ | ACHE | P22303 | 2/20 | 0.41 |
| ▸ | NCF1 | P14598 | 1/20 | 0.41 |
| ▸ | BDKRB1 | P46663 | 2/20 | 0.40 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.39 |
| ▸ | BCHE | P06276 | 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 | |
|---|---|---|---|---|
| SCHEMBL15432290 | 0.85 | ITGB3 (0.43) | ITGB3ITGA2BF2RGNAI3GNAO1 | |
| SCHEMBL19658636 | 0.84 | ITGB3 (0.45) | ITGB3ITGA2BF2RGNAI3GNAO1 | |
| SCHEMBL24577535 | 0.84 | NCF1 (0.44) | ITGB3ITGA2BF2RGNAI3GNAO1 | |
| SCHEMBL17293661 | 0.82 | EPHX2 (0.43) | SIGMAR1ACHEEPHX1 | |
| SCHEMBL27006792 | 0.82 | TPSAB1 (0.42) | ITGB3ITGA2BF2RGNAI3GNAO1 | |
| SCHEMBL16494745 | 0.81 | CYP2D6 (0.50) | ITGB3ITGA2BF2RNCF1EPHX1 | |
| SCHEMBL7447536 | 0.80 | TPSAB1 (0.46) | ITGB3ITGA2BF2R | |
| Acetic Acid SCHEMBL5786906 | 0.80 | ITGB3 (0.42) | ITGB3ITGA2BF2RGNAI3GNAO1 | |
| SCHEMBL12021721 | 0.78 | EPHX1 (0.48) | EPHX1 | |
| SCHEMBL21730550 | 0.78 | ACHE (0.44) | ITGB3ITGA2BF2RACHEBCHE |
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 |
|---|---|---|---|---|---|---|---|
| EP-1515724-B1 | MITOTIC KINESIN INHIBITORS | MERCK & CO INC (US) | 2009-10-21 | — | — | EP | claimed |