Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BCHE | P06276 | 1/20 | 0.47 |
| ▸ | ITGB3 | P05106 | 3/20 | 0.40 |
| ▸ | ITGA2B | P08514 | 3/20 | 0.40 |
| ▸ | F2R | P25116 | 2/20 | 0.40 |
| ▸ | GAA | P10253 | 2/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | MMP1 | P03956 | 1/20 | 0.39 |
| ▸ | MMP9 | P14780 | 1/20 | 0.39 |
| ▸ | MMP13 | P45452 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 2/20 | 0.38 |
| ▸ | CA12 | O43570 | 1/20 | 0.38 |
| ▸ | CA1 | P00915 | 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 | |
|---|---|---|---|---|
| SCHEMBL5540743 | 0.85 | BCHE (0.43) | BCHEITGB3ITGA2BF2RGAA | |
| SCHEMBL11922670 | 0.83 | ALDH1A1 (0.52) | BCHEITGB3ITGA2BF2RGAA | |
| SCHEMBL14447744 | 0.81 | BCHE (0.50) | BCHEGAACYP2C9CYP2C19ALDH1A1 | |
| SCHEMBL28447168 | 0.81 | ALDH1A1 (0.46) | ALDH1A1MAPK1KDM4ELMNAMEN1 | |
| SCHEMBL11922963 | 0.81 | ALDH1A1 (0.46) | ALDH1A1MAPK1KDM4ELMNAMEN1 | |
| SCHEMBL30606200 | 0.81 | BCHE (0.50) | BCHEITGB3ITGA2BF2RGAA | |
| SCHEMBL12409536 | 0.81 | BCHE (0.50) | BCHEGAACYP2C9CYP2C19ALDH1A1 | |
| SCHEMBL15085132 | 0.81 | BCHE (0.50) | BCHEITGB3ITGA2BF2RGAA | |
| SCHEMBL15865743 | 0.81 | DUSP22 (0.40) | ALDH1A1MMP1MMP9MMP13LMNA | |
| SCHEMBL5542690 | 0.81 | ITGB3 (0.49) | ITGB3ITGA2BF2RGAAALDH1A1 |
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-8367666-B2 | 3-carbamoyl-2-pyridone derivatives | SHIONOGI & CO., LTD. (JP) | 2013-02-05 | — | — | US | disclosed |