Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.67 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.67 |
| ▸ | DHODH | Q02127 | 3/20 | 0.66 |
| ▸ | GAA | P10253 | 2/20 | 0.66 |
| ▸ | MEN1 | O00255 | 2/20 | 0.56 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.56 |
| ▸ | GPR35 | Q9HC97 | 1/20 | 0.54 |
| ▸ | MAPT | P10636 | 7/20 | 0.53 |
| ▸ | NPSR1 | Q6W5P4 | 5/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.52 |
| ▸ | LMNA | P02545 | 1/20 | 0.52 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.51 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.50 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.50 |
| ▸ | RECQL | P46063 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL10860452 | 0.89 | CYP3A4 (0.75) | CYP3A4CYP2D6DHODHGAAMEN1 | |
| SCHEMBL4147856 | 0.89 | DHODH (0.74) | CYP3A4CYP2D6DHODHGAAMEN1 | |
| SCHEMBL11653020 | 0.86 | CYP3A4 (0.64) | CYP3A4CYP2D6DHODHGAAMEN1 | |
| SCHEMBL11650560 | 0.86 | CYP3A4 (0.64) | CYP3A4CYP2D6DHODHGAAMEN1 | |
| SCHEMBL18987741 | 0.86 | CYP3A4 (0.64) | CYP3A4CYP2D6DHODHGAAMEN1 | |
| SCHEMBL11655450 | 0.85 | CYP3A4 (0.62) | CYP3A4CYP2D6DHODHGAAMEN1 | |
| SCHEMBL11656183 | 0.84 | CYP3A4 (0.61) | CYP3A4CYP2D6DHODHGAAMEN1 | |
| SCHEMBL10860945 | 0.84 | CYP3A4 (0.59) | CYP3A4CYP2D6DHODHGAAMEN1 | |
| SCHEMBL11650465 | 0.83 | CYP3A4 (0.60) | CYP3A4CYP2D6DHODHGAAMEN1 | |
| SCHEMBL20621768 | 0.83 | MAPT (0.54) | CYP3A4CYP2D6DHODHGAAMEN1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0174832-A2 | Ethene derivatives | MAY & BAKER LIMITED (GB) | 1986-03-19 | — | — | EP | disclosed |