Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FAAH | O00519 | 7/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 2/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.35 |
| ▸ | P2RY12 | Q9H244 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL3916351 | 0.90 | GAA (0.34) | MAPTTSHRALDH1A1GAASMN1; SMN2 | |
| SCHEMBL3925602 | 0.88 | GAA (0.36) | TSHRALDH1A1GAASMN1; SMN2 | |
| SCHEMBL4038594 | 0.86 | P2RX7 (0.33) | MAPTTSHRALDH1A1GAASMN1; SMN2 | |
| SCHEMBL4042715 | 0.85 | FEN1 (0.33) | MAPTTSHRALDH1A1GAASMN1; SMN2 | |
| SCHEMBL4036440 | 0.84 | TSHR (0.34) | TSHRALDH1A1GAASMN1; SMN2 | |
| SCHEMBL3927003 | 0.84 | DRD4 (0.39) | ALDH1A1GAA | |
| SCHEMBL4036735 | 0.84 | MAPT (0.43) | FAAHCYP2D6CYP1A2MAPTTSHR | |
| SCHEMBL4032369 | 0.83 | GAA (0.32) | MAPTTSHRALDH1A1GAASMN1; SMN2 | |
| SCHEMBL3926877 | 0.83 | HRH3 (0.39) | ALDH1A1SMN1; SMN2P2RY12 | |
| SCHEMBL3920554 | 0.83 | KDM4E (0.36) | FAAHMAPTALDH1A1KDM4EGAA |
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-1730144-B1 | SUBSTITUTED 1,4,8-TRIAZASPIRO¬4.5 DECAN-2-ONE COMPOUNDS | GRUENENTHAL GMBH (DE) | 2009-06-10 | — | — | EP | claimed |