Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MCHR1 | Q99705 | 2/20 | 0.41 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.39 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.37 |
| ▸ | AKR1C3 | P42330 | 2/20 | 0.37 |
| ▸ | AKR1C2 | P52895 | 2/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | GMNN | O75496 | 1/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | HTR1A | P08908 | 1/20 | 0.37 |
| ▸ | THRB | P10828 | 1/20 | 0.37 |
| ▸ | PIM1 | P11309 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | MAOA | P21397 | 1/20 | 0.37 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.37 |
| ▸ | HTR2A | P28223 | 1/20 | 0.37 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL4433211 | 0.84 | LMNA (0.41) | MAPK14LMNAAKR1C3AKR1C2SMN1; SMN2 | |
| SCHEMBL4441781 | 0.80 | MEN1 (0.41) | MAPK14LMNAAKR1C3AKR1C2SMN1; SMN2 | |
| SCHEMBL4435069 | 0.77 | CES2 (0.41) | MAPK14LMNAAKR1C3AKR1C2SMN1; SMN2 | |
| SCHEMBL4432946 | 0.74 | FFAR1 (0.42) | MAPK14LMNAAKR1C3AKR1C2SMN1; SMN2 | |
| SCHEMBL2304585 | 0.70 | ACP3 (0.56) | NPC1RAB9ACES2CES1ALDH1A1 | |
| SCHEMBL3729711 | 0.69 | KCNH2 (0.53) | MCHR1KCNH2LMNASMN1; SMN2RAB9A | |
| SCHEMBL4431561 | 0.69 | AKR1C3 (0.48) | AKR1C3AKR1C2PDE2ACES2CES1 | |
| SCHEMBL4438527 | 0.69 | CES2 (0.50) | AKR1C3AKR1C2SMN1; SMN2CYP1A2CYP3A4 | |
| SCHEMBL4432335 | 0.69 | CES2 (0.41) | AKR1C3AKR1C2TP53PDE2ACES2 | |
| SCHEMBL4435426 | 0.69 | CNR1 (0.40) | LMNAAKR1C3AKR1C2SMN1; SMN2PDE2A |
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 |