Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | THRB | P10828 | 2/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | GMNN | O75496 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | HTR1A | P08908 | 1/20 | 0.41 |
| ▸ | PIM1 | P11309 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | MAOA | P21397 | 1/20 | 0.41 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.41 |
| ▸ | HTR2A | P28223 | 1/20 | 0.41 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.41 |
| ▸ | CCKBR | P32239 | 1/20 | 0.41 |
| ▸ | MC4R | P32245 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | THPO | P40225 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL4439322 | 0.84 | MCHR1 (0.41) | LMNATHRBNPC1GMNNTP53 | |
| SCHEMBL4435069 | 0.80 | CES2 (0.41) | LMNATHRBNPC1GMNNTP53 | |
| SCHEMBL4441781 | 0.80 | MEN1 (0.41) | LMNATHRBNPC1GMNNTP53 | |
| SCHEMBL4432335 | 0.74 | CES2 (0.41) | TP53CES2CES1PDE2AAKR1C3 | |
| SCHEMBL4432946 | 0.73 | FFAR1 (0.42) | LMNATHRBNPC1GMNNTP53 | |
| SCHEMBL4435426 | 0.73 | CNR1 (0.40) | LMNASMN1; SMN2CES2CES1PDE2A | |
| SCHEMBL2304585 | 0.72 | ACP3 (0.56) | NPC1RAB9ACES2CES1ALDH1A1 | |
| SCHEMBL4435804 | 0.72 | HSD11B1 (0.45) | SMN1; SMN2CES2CES1PDE2A | |
| SCHEMBL4432365 | 0.71 | AKR1C3 (0.43) | CES2CES1PDE2AAKR1C3AKR1C2 | |
| SCHEMBL4438527 | 0.71 | CES2 (0.50) | CYP1A2CYP3A4CYP2C9SMN1; SMN2NPSR1 |
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 |