Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.41 |
| ▸ | ULK1 | O75385 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | CNR1 | P21554 | 1/20 | 0.37 |
| ▸ | CNR2 | P34972 | 1/20 | 0.37 |
| ▸ | GPR88 | Q9GZN0 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | MMP1 | P03956 | 3/20 | 0.36 |
| ▸ | MMP2 | P08253 | 3/20 | 0.36 |
| ▸ | MMP3 | P08254 | 3/20 | 0.36 |
| ▸ | MMP9 | P14780 | 3/20 | 0.36 |
| ▸ | MMP14 | P50281 | 3/20 | 0.36 |
| ▸ | CCR2 | P41597 | 2/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL4441392 | 1.00 | ALDH1A1 (0.41) | ALDH1A1KDM4EULK1KMT2ACNR1 | |
| SCHEMBL4432784 | 0.88 | CNR1 (0.51) | ALDH1A1KDM4EKMT2ACNR1CNR2 | |
| SCHEMBL4434615 | 0.88 | CNR1 (0.51) | ALDH1A1KDM4EKMT2ACNR1CNR2 | |
| SCHEMBL4433690 | 0.88 | CNR1 (0.51) | ALDH1A1KDM4EKMT2ACNR1CNR2 | |
| SCHEMBL4429219 | 0.88 | CNR1 (0.51) | ALDH1A1KDM4EKMT2ACNR1CNR2 | |
| SCHEMBL4430647 | 0.84 | KDM4E (0.46) | ALDH1A1KDM4ECNR1CNR2CCR2 | |
| SCHEMBL4441795 | 0.84 | KDM4E (0.46) | ALDH1A1KDM4ECNR1CNR2CCR2 | |
| SCHEMBL4433145 | 0.84 | CNR1 (0.45) | ALDH1A1KDM4EKMT2ACNR1CNR2 | |
| SCHEMBL4438661 | 0.83 | KDM4E (0.45) | ALDH1A1KDM4EKMT2ACCR2SMN1; SMN2 | |
| SCHEMBL4440273 | 0.83 | KDM4E (0.45) | ALDH1A1KDM4EKMT2ACCR2SMN1; SMN2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2114867-A1 | AMINOAMIDES AS OREXIN ANTAGONISTS | F. Hoffmann-Roche AG (CH) | 2009-11-11 | — | — | EP | disclosed |
| WO-2008107335-A1 | AMINOAMIDES AS OREXIN ANTAGONISTS | F. HOFFMANN-LA ROCHE AG (CH) | 2008-09-12 | — | — | WO | disclosed |