Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.50 |
| ▸ | POLB | P06746 | 3/20 | 0.50 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.45 |
| ▸ | HTR2B | P41595 | 3/20 | 0.43 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | USP30 | Q70CQ3 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL743205 | 0.92 | HTR2B (0.53) | KDM4EPOLBMAPK1CYP1A2CYP3A4 | |
| SCHEMBL740995 | 0.92 | GRIN2B (0.54) | KDM4EPOLBMAPK1CYP1A2CYP3A4 | |
| SCHEMBL762472 | 0.88 | POLB (0.46) | KDM4EPOLBMAPK1CYP1A2CYP3A4 | |
| SCHEMBL741819 | 0.86 | POLB (0.49) | KDM4EPOLBMAPK1CYP1A2CYP3A4 | |
| SCHEMBL763190 | 0.82 | HTR2B (0.47) | KDM4EPOLBMAPK1CYP1A2CYP3A4 | |
| SCHEMBL739281 | 0.81 | POLB (0.46) | KDM4EPOLBMAPK1CYP1A2CYP3A4 | |
| SCHEMBL763367 | 0.80 | GRIN2B (0.49) | KDM4EPOLBMAPK1CYP1A2CYP3A4 | |
| SCHEMBL762470 | 0.80 | GRIN2B (0.49) | KDM4EPOLBMAPK1CYP1A2CYP3A4 | |
| SCHEMBL763468 | 0.80 | GRIN2B (0.49) | KDM4EPOLBMAPK1CYP1A2CYP3A4 | |
| SCHEMBL742498 | 0.79 | HRH1 (0.49) | POLBCYP2D6 |
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-8138168-B1 | Renin inhibitors | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2012-03-20 | — | — | US | disclosed |