Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 6/20 | 0.52 |
| ▸ | CYP1A2 | P05177 | 5/20 | 0.52 |
| ▸ | CYP3A4 | P08684 | 5/20 | 0.52 |
| ▸ | CYP2C19 | P33261 | 5/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.52 |
| ▸ | MAPT | P10636 | 4/20 | 0.52 |
| ▸ | CYP2D6 | P10635 | 4/20 | 0.52 |
| ▸ | LMNA | P02545 | 4/20 | 0.52 |
| ▸ | TSHR | P16473 | 4/20 | 0.52 |
| ▸ | MEN1 | O00255 | 3/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.52 |
| ▸ | HIF1A | Q16665 | 3/20 | 0.52 |
| ▸ | ABCB11 | O95342 | 3/20 | 0.52 |
| ▸ | ADORA3 | P0DMS8 | 3/20 | 0.52 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.52 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.52 |
| ▸ | HPGD | P15428 | 2/20 | 0.52 |
| ▸ | PGR | P06401 | 2/20 | 0.52 |
| ▸ | ABCB1 | P08183 | 2/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL10373726 | 0.92 | CYP2C9 (0.39) | CYP2C9CYP1A2CYP3A4CYP2C19KDM4E | |
| SCHEMBL11001087 | 0.89 | CYP2C9 (0.56) | CYP2C9CYP1A2CYP3A4CYP2C19KDM4E | |
| SCHEMBL10366682 | 0.88 | CYP2C9 (0.40) | CYP2C9CYP1A2CYP3A4CYP2C19KDM4E | |
| SCHEMBL10996822 | 0.85 | CYP2C9 (0.62) | CYP2C9CYP1A2CYP3A4CYP2C19KDM4E | |
| SCHEMBL10999485 | 0.84 | CYP2C9 (0.48) | CYP2C9CYP1A2CYP3A4CYP2C19KDM4E | |
| SCHEMBL7312562 | 0.83 | LMNA (0.48) | CYP2C9CYP1A2CYP3A4CYP2C19KDM4E | |
| SCHEMBL10994856 | 0.82 | KDM4E (0.61) | CYP2C9CYP1A2CYP3A4CYP2C19KDM4E | |
| SCHEMBL10994961 | 0.81 | CYP2C9 (0.50) | CYP2C9CYP1A2CYP3A4CYP2C19KDM4E | |
| SCHEMBL7308471 | 0.81 | CYP1A2 (0.65) | CYP2C9CYP1A2CYP3A4CYP2C19KDM4E | |
| SCHEMBL30358017 | 0.81 | CYP1A2 (0.65) | CYP2C9CYP1A2CYP3A4CYP2C19KDM4E |
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 |
|---|---|---|---|---|---|---|---|
| EP-0177965-B1 | NOVEL OXA- AND THIADIAZOLYL DERIVATIVES AND THEIR USE | SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) | 1990-03-21 | — | — | EP | claimed |
| US-4705786-A | Novel oxadiazolyl-1,4-dihydropyridines useful as antihypertensive agents | SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) | 1987-11-10 | — | — | US | claimed |
| EP-0177965-A2 | Novel oxa- and thiadiazolyl derivatives and their use | SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) | 1986-04-16 | — | — | EP | claimed |