Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK1 | P28482 | 1/20 | 0.65 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.63 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.63 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.63 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.63 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.63 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.63 |
| ▸ | POLB | P06746 | 3/20 | 0.54 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.53 |
| ▸ | USP2 | O75604 | 1/20 | 0.51 |
| ▸ | TP53 | P04637 | 1/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.49 |
| ▸ | GAA | P10253 | 1/20 | 0.48 |
| ▸ | HTR2B | P41595 | 1/20 | 0.48 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.47 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL763386 | 0.85 | MAPK1 (0.79) | MAPK1SMN1; SMN2CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL740765 | 0.80 | POLB (0.78) | MAPK1SMN1; SMN2CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL13853671 | 0.78 | POLB (0.62) | MAPK1SMN1; SMN2CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL742419 | 0.78 | MAPK1 (0.60) | MAPK1SMN1; SMN2CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL739044 | 0.77 | POLB (0.62) | MAPK1SMN1; SMN2CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL19399629 | 0.76 | GRIN2B (0.75) | MAPK1SMN1; SMN2CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL739176 | 0.75 | MAPK1 (0.56) | MAPK1SMN1; SMN2CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL740518 | 0.75 | MAPK1 (0.56) | MAPK1SMN1; SMN2CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL739175 | 0.75 | MAPK1 (0.56) | MAPK1SMN1; SMN2CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL739633 | 0.75 | POLB (0.48) | MAPK1SMN1; SMN2CYP1A2CYP3A4CYP2D6 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8138168-B1 | Renin inhibitors | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2012-03-20 | — | — | US | disclosed |
| US-8138168-B1 | Renin inhibitors | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2012-03-20 | — | — | US | disclosed |
| US-8138168-B1 | Renin inhibitors | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2012-03-20 | — | — | US | disclosed |