Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CASR | P41180 | 4/20 | 0.45 |
| ▸ | AKR1C3 | P42330 | 2/20 | 0.44 |
| ▸ | AKR1C2 | P52895 | 2/20 | 0.44 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.44 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.44 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.44 |
| ▸ | KCNK2 | O95069 | 1/20 | 0.44 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.44 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | PPARD | Q03181 | 2/20 | 0.41 |
| ▸ | PPARA | Q07869 | 2/20 | 0.41 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.40 |
| ▸ | RORC | P51449 | 1/20 | 0.40 |
| ▸ | ACHE | P22303 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | ATM | Q13315 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL4433951 | 0.86 | AKR1C3 (0.50) | CASRAKR1C3AKR1C2MEN1KMT2A | |
| SCHEMBL4433142 | 0.82 | SLC6A2 (0.55) | SLC6A2SLC6A4SLC6A3KCNK2KCNH2 | |
| SCHEMBL4441454 | 0.82 | MEN1 (0.60) | MEN1KMT2AMAPK1PPARDPPARA | |
| Hydrochloric Acid SCHEMBL4441383 | 0.81 | SLC6A2 (0.54) | SLC6A2SLC6A4SLC6A3KCNK2KCNH2 | |
| SCHEMBL4430515 | 0.81 | PDE4A (0.48) | MEN1KMT2APPARDPPARAACHE | |
| SCHEMBL4432755 | 0.81 | AKR1C3 (0.51) | AKR1C3AKR1C2PPARDPPARARORC | |
| SCHEMBL4432893 | 0.81 | SLC6A2 (0.51) | CASRSLC6A2SLC6A4SLC6A3KCNK2 | |
| SCHEMBL4441719 | 0.80 | AKR1C3 (0.46) | CASRAKR1C3AKR1C2MEN1KMT2A | |
| SCHEMBL14387383 | 0.78 | SLC6A2 (0.48) | CASRSLC6A2SLC6A4SLC6A3KCNK2 | |
| SCHEMBL4434646 | 0.78 | AKR1C3 (0.45) | CASRAKR1C3AKR1C2MAPK1CYP19A1 |
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 |