Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK1 | P28482 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | HTT | P42858 | 2/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.36 |
| ▸ | PKM | P14618 | 1/20 | 0.36 |
| ▸ | ATM | Q13315 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | CA12 | O43570 | 1/20 | 0.35 |
| ▸ | CA2 | P00918 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL9263856 | 0.84 | HTT (0.38) | CYP2C19CYP1A2CYP2C9KDM4EMEN1 | |
| SCHEMBL9276524 | 0.83 | MAPK1 (0.46) | MAPK1CYP2C19CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL9255169 | 0.82 | CYP1A2 (0.43) | CYP2C19CYP1A2CYP2C9L3MBTL1SMN1; SMN2 | |
| SCHEMBL9259026 | 0.80 | ADORA2A (0.38) | CYP2C19CYP1A2CYP2C9MEN1KMT2A | |
| SCHEMBL9263794 | 0.76 | HTT (0.40) | CYP2C19CYP1A2CYP3A4SMN1; SMN2KDM4E | |
| SCHEMBL9256929 | 0.73 | MAP3K5 (0.39) | CYP2C19CYP1A2HTTMAPT | |
| SCHEMBL11248747 | 0.71 | KDM4E (0.60) | MAPK1CYP2C19CYP1A2L3MBTL1SMN1; SMN2 | |
| SCHEMBL8947294 | 0.71 | MAPK1 (0.61) | MAPK1CYP2C19CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL8843434 | 0.69 | HTT (0.57) | MAPK1CYP2C19CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL9256353 | 0.69 | KDM4E (0.36) | MAPK1KDM4EGAAMEN1KMT2A |
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-5475000-A | Antiulcer agents | CHINOIN GYOGYSZER-ES VEGYESZETI TERMEKEK GYARA RT. (HU) | 1995-12-12 | — | — | US | disclosed |