Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | ATM | Q13315 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.30 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.30 |
| ▸ | DRD3 | P35462 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL7163205 | 0.80 | CYP1A2 (0.38) | CYP1A2GAAATMMEN1CYP3A4 | |
| SCHEMBL16221475 | 0.76 | — | — | |
| SCHEMBL17911726 | 0.75 | HSD17B3 (0.39) | — | |
| SCHEMBL6538246 | 0.74 | KDM4E (0.50) | CYP1A2GAAMEN1KMT2A | |
| SCHEMBL10592697 | 0.73 | POLB (0.33) | CYP1A2ATMMEN1KMT2A | |
| SCHEMBL757738 | 0.73 | POLB (0.35) | CYP1A2MEN1KMT2A | |
| SCHEMBL1782265 | 0.73 | SLC6A3 (0.31) | — | |
| SCHEMBL10245913 | 0.73 | MEN1 (0.34) | CYP1A2GAAMEN1CYP3A4PTGS1 | |
| SCHEMBL17031888 | 0.73 | CYP1A2 (0.34) | CYP1A2GAAMEN1CYP3A4PTGS1 | |
| SCHEMBL8480122 | 0.72 | KDM4E (0.48) | GAAMEN1KMT2A |
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-2046147-B1 | METHOD OF USING ORGANIC COMPOUNDS | GIVAUDAN SA (CH) | 2013-05-01 | — | — | EP | claimed |