Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.48 |
| ▸ | ITGB3 | P05106 | 4/20 | 0.47 |
| ▸ | ITGA2B | P08514 | 4/20 | 0.47 |
| ▸ | CYP26A1 | O43174 | 1/20 | 0.47 |
| ▸ | EEF2K | O00418 | 3/20 | 0.47 |
| ▸ | CTSA | P10619 | 4/20 | 0.46 |
| ▸ | MMP3 | P08254 | 1/20 | 0.46 |
| ▸ | MMP9 | P14780 | 1/20 | 0.46 |
| ▸ | MMP8 | P22894 | 1/20 | 0.46 |
| ▸ | MMP12 | P39900 | 1/20 | 0.46 |
| ▸ | MMP13 | P45452 | 1/20 | 0.46 |
| ▸ | GABBR2 | O75899 | 1/20 | 0.46 |
| ▸ | GABBR1 | Q9UBS5 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | ATM | Q13315 | 1/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
| ▸ | ITGAV | P06756 | 1/20 | 0.45 |
| ▸ | ITGB5 | P18084 | 1/20 | 0.45 |
| ▸ | ITGB6 | P18564 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL13933839 | 0.84 | ITGB3 (0.46) | ITGB3ITGAV | |
| SCHEMBL18943048 | 0.83 | RIPK1 (0.57) | — | |
| SCHEMBL15586927 | 0.83 | RIPK1 (0.57) | — | |
| SCHEMBL13993517 | 0.83 | RIPK1 (0.57) | — | |
| SCHEMBL12832254 | 0.81 | GABBR2 (0.55) | SMN1; SMN2ITGB3ITGA2BCYP26A1EEF2K | |
| SCHEMBL12832401 | 0.81 | GABBR2 (0.55) | SMN1; SMN2ITGB3ITGA2BCYP26A1EEF2K | |
| SCHEMBL2851129 | 0.81 | KMT2A (0.58) | SMN1; SMN2CYP26A1ALDH1A1L3MBTL1 | |
| SCHEMBL3375103 | 0.81 | KMT2A (0.58) | SMN1; SMN2CYP26A1ALDH1A1L3MBTL1 | |
| SCHEMBL640977 | 0.81 | KMT2A (0.58) | SMN1; SMN2CYP26A1ALDH1A1L3MBTL1 | |
| SCHEMBL22995641 | 0.80 | MEN1 (0.61) | SMN1; SMN2ITGB3ITGA2BCYP26A1CTSA |
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-7427637-B2 | Mitotic kinesin inhibitors | MERCK & CO. INC. (US) | 2008-09-23 | — | — | US | disclosed |